Chemical ID: 5812954

CC1CCCCN1C(=O)c2ccc(cc2)N
Chemical ID:
5812954
Name [?]:
(4-aminophenyl)-(2-methyl-1-piperidyl)-methanone
SMILES [?]:
CC1CCCCN1C(=O)c2ccc(cc2)N
InChi [?]:
InChI=1/C13H18N2O/c1-10-4-2-3-9-15(10)13(16)11-5-7-12(14)8-6-11/h5-8,10H,2-4,9,14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,5,3,11,15,12,14,6,2,10,13,8,16,7,9/E:(5,6)(7,8)/rA:16cCCCCCCNCOCCCCCCN/rB:s1;s2;s3;s4;s5;s2s6;s7;d8;s8;s10;d11;s12;d13;d10s14;s13;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H18N2O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:8.09053
Area:389.37
Solvation:-1.64373
Coulombic:-34.5758
Bond Count [?]
All:17
Single:13
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:218.295
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.08
LogP (Chemaxon):1.54

Name Annotations

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Descriptor Annotations

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