Chemical ID: 6658845

C1CCC(CC1)NCCC(=O)O
Chemical ID:
6658845
Name [?]:
3-cyclohexylaminopropanoic acid
SMILES [?]:
C1CCC(CC1)NCCC(=O)O
InChi [?]:
InChI=1/C9H17NO2/c11-9(12)6-7-10-8-4-2-1-3-5-8/h8,10H,1-7H2,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,9,8,4,10,7,11,12/E:(2,3)(4,5)(11,12)/rA:12nCCCCCCNCCCOO/rB:s1;s2;s3;s4;s1s5;s4;s7;s8;s9;d10;s10;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H17NO2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.12456
Area:353.495
Solvation:-1.71282
Coulombic:-35.0811
Bond Count [?]
All:12
Single:11
Double:1
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:171.237
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.84
LogP (Chemaxon):-1.35

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Descriptor Annotations

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