Chemical ID: 6485559

CNC(=O)CC1(CCCC1)CC(=O)O
Chemical ID:
6485559
Name [?]:
2-[1-(methylcarbamoylmethyl)cyclopentyl]acetic acid
SMILES [?]:
CNC(=O)CC1(CCCC1)CC(=O)O
InChi [?]:
InChI=1/C10H17NO3/c1-11-8(12)6-10(7-9(13)14)4-2-3-5-10/h2-7H2,1H3,(H,11,12)(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,8,9,7,10,5,11,3,12,6,2,4,13,14/E:(2,3)(4,5)(13,14)/rA:14nCNCOCCCCCCCCOO/rB:s1;s2;d3;s3;s5;s6;s7;s8;s6s9;s6;s11;d12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H17NO3
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.97919
Area:367.075
Solvation:-2.19768
Coulombic:-46.4591
Bond Count [?]
All:14
Single:12
Double:2
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:199.247
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.35
LogP (Chemaxon):0.45

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