Chemical ID: 5169671

CC1CCC(C1)NC2=NCCO2
Chemical ID:
5169671
Name [?]:
N-(3-methylcyclopentyl)-4,5-dihydrooxazol-2-amine
SMILES [?]:
CC1CCC(C1)NC2=NCCO2
InChi [?]:
InChI=1/C9H16N2O/c1-7-2-3-8(6-7)11-9-10-4-5-12-9/h7-8H,2-6H2,1H3,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,3,4,10,11,6,2,5,8,9,7,12/rA:12cCCCCCCNCNCCO/rB:s1;s2;s3;s4;s2s5;s5;s7;d8;s9;s10;s8s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H16N2O
All Atoms:12
Heavy Atoms:12
Chiral Atoms:2
ZAP Information [?]
Total:6.34634
Area:341.11
Solvation:-2.18141
Coulombic:-26.9898
Bond Count [?]
All:13
Single:12
Double:1
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:168.236
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.91
LogP (Chemaxon):1.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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