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Chemical ID: 5895394

COCCCNC(=O)c1cc(ccc1N2CCCCC2)NC(=O)C3CCCCC3

Chemical ID:

5895394

Name [?]:

5-cyclohexylcarbonylamino-N-(3-methoxypropyl)-2-(1-piperidyl)benzamide

SMILES [?]:

COCCCNC(=O)c1cc(ccc1N2CCCCC2)NC(=O)C3CCCCC3

InChi [?]:

InChI=1/C23H35N3O3/c1-29-16-8-13-24-23(28)20-17-19(25-22(27)18-9-4-2-5-10-18)11-12-21(20)26-14-6-3-7-15-26/h11-12,17-18H,2-10,13-16H2,1H3,(H,24,28)(H,25,27)

InChi Info:

AuxInfo=1/1/N:1,27,18,26,28,17,19,4,25,29,12,13,5,16,20,3,10,24,11,9,14,22,7,6,21,15,23,8,2/E:(4,5)(6,7)(9,10)(14,15)/rA:29nCOCCCNCOCCCCCCNCCCCCNCOCCCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;d10;s11;d12;d9s13;s14;s15;s16;s17;s18;s15s19;s11;s21;d22;s22;s24;s25;s26;s27;s24s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₃₅N₃O₃
All Atoms:	29
Heavy Atoms:	29
Chiral Atoms:	0

ZAP Information [?]

Total:	11.285
Area:	660.588
Solvation:	-5.22972
Coulombic:	-55.0456

Bond Count [?]

All:	31
Single:	26
Double:	5
Rotors:	10
Chiral:	0
Rigid Segments:	8

Chemical Properties

Molecular Weight:	401.542
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	3.84
LogP (Chemaxon):	3.02

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value