Chemical ID: 4178157

CC(CN1CCCC(C1)C(=O)N)c2ccccc2
Chemical ID:
4178157
Name [?]:
1-(2-phenylpropyl)piperidine-3-carboxamide
SMILES [?]:
CC(CN1CCCC(C1)C(=O)N)c2ccccc2
InChi [?]:
InChI=1/C15H22N2O/c1-12(13-6-3-2-4-7-13)10-17-9-5-8-14(11-17)15(16)18/h2-4,6-7,12,14H,5,8-11H2,1H3,(H2,16,18)
InChi Info:
AuxInfo=1/1/N:1,16,15,17,6,14,18,7,5,3,9,2,13,8,10,12,4,11/E:(3,4)(6,7)/rA:18cCCCNCCCCCCONCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s4s8;s8;d10;s10;s2;s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H22N2O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:3
ZAP Information [?]
Total:9.01313
Area:449.502
Solvation:-2.22441
Coulombic:-31.7398
Bond Count [?]
All:19
Single:15
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:246.348
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.41
LogP (Chemaxon):1.92

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Descriptor Annotations

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