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Chemical ID: 6036958

Chemical ID:

6036958

Name [?]:

N-(3-methoxypropyl)-N-[2-(1-piperidylcarbonyl)ethyl]furan-3-carboxamide

SMILES [?]:

COCCCN(CCC(=O)N1CCCCC1)C(=O)c2ccoc2

InChi [?]:

InChI=1/C17H26N2O4/c1-22-12-5-10-19(17(21)15-7-13-23-14-15)11-6-16(20)18-8-3-2-4-9-18/h7,13-14H,2-6,8-12H2,1H3

InChi Info:

AuxInfo=1/0/N:1,14,13,15,4,8,20,12,16,5,7,3,21,23,19,9,17,11,6,10,18,2,22/E:(3,4)(8,9)/rA:23nCOCCCNCCCONCCCCCCOCCCOC/rB:s1;s2;s3;s4;s5;s6;s7;s8;d9;s9;s11;s12;s13;s14;s11s15;s6;d17;s17;s19;d20;s21;d19s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₇H₂₆N₂O₄
All Atoms:	23
Heavy Atoms:	23
Chiral Atoms:	0

ZAP Information [?]

Total:	8.46908
Area:	551.641
Solvation:	-5.32196
Coulombic:	-45.6916

Bond Count [?]

All:	24
Single:	20
Double:	4
Rotors:	10
Chiral:	0
Rigid Segments:	8

Chemical Properties

Molecular Weight:	322.399
H-Bond Donors:	0
H-Bond Acceptors:	5
XLogP:	0.68
LogP (Chemaxon):	0.34

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value