Chemical ID: 4979825

CC(C)C1CCCC1(C(=O)O)N
Chemical ID:
4979825
Name [?]:
1-amino-2-isopropyl-cyclopentane-1-carboxylic acid
SMILES [?]:
CC(C)C1CCCC1(C(=O)O)N
InChi [?]:
InChI=1/C9H17NO2/c1-6(2)7-4-3-5-9(7,10)8(11)12/h6-7H,3-5,10H2,1-2H3,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,3,6,5,7,2,4,9,8,12,10,11/E:(1,2)(11,12)/rA:12cCCCCCCCCCOON/rB:s1;s2;s2;s4;s5;s6;s4s7;s8;d9;s9;s8;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H17NO2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:2
ZAP Information [?]
Total:6.34397
Area:319.789
Solvation:-1.65076
Coulombic:-40.7575
Bond Count [?]
All:12
Single:11
Double:1
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:171.237
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:-0.96
LogP (Chemaxon):-1.06

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Descriptor Annotations

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