Chemical ID: 5065221

c1ccc(cc1)C2(CCCCC2)N
Chemical ID:
5065221
Name [?]:
1-phenylcyclohexan-1-amine
SMILES [?]:
c1ccc(cc1)C2(CCCCC2)N
InChi [?]:
InChI=1/C12H17N/c13-12(9-5-2-6-10-12)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,13H2
InChi Info:
AuxInfo=1/0/N:1,10,2,6,9,11,3,5,8,12,4,7,13/E:(3,4)(5,6)(7,8)(9,10)/rA:13nCCCCCCCCCCCCN/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s7s11;s7;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17N
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.6516
Area:340.687
Solvation:-0.865568
Coulombic:-14.9369
Bond Count [?]
All:14
Single:11
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:175.27
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:2.73
LogP (Chemaxon):2.48

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Descriptor Annotations

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