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Chemical ID: 7029275

Chemical ID:

7029275

Name [?]:

2-[1-(dimethylcarbamoylmethyl)cyclopentyl]-N,N-diethyl-acetamide

SMILES [?]:

CCN(CC)C(=O)CC1(CCCC1)CC(=O)N(C)C

InChi [?]:

InChI=1/C15H28N2O2/c1-5-17(6-2)14(19)12-15(9-7-8-10-15)11-13(18)16(3)4/h5-12H2,1-4H3

InChi Info:

AuxInfo=1/0/N:1,5,18,19,2,4,11,12,10,13,14,8,15,6,9,17,3,16,7/E:(1,2)(3,4)(5,6)(7,8)(9,10)/rA:19nCCNCCCOCCCCCCCCONCC/rB:s1;s2;s3;s4;s3;d6;s6;s8;s9;s10;s11;s9s12;s9;s14;d15;s15;s17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₅H₂₈N₂O₂
All Atoms:	47
Heavy Atoms:	19
Chiral Atoms:	0

ZAP Information [?]

Total:	9.71296
Area:	476.171
Solvation:	-2.1913
Coulombic:	-32.0632

Bond Count [?]

All:	19
Single:	17
Double:	2
Rotors:	8
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	268.395
H-Bond Donors:	0
H-Bond Acceptors:	4
XLogP:	2.27
LogP (Chemaxon):	1.01

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value