Chemical ID: 7096737

c1ccc(c(c1)C(=O)N)NC(=O)c2cccnc2N3CCCCC3
Chemical ID:
7096737
Name [?]:
N-(2-carbamoylphenyl)-2-(1-piperidyl)pyridine-3-carboxamide
SMILES [?]:
c1ccc(c(c1)C(=O)N)NC(=O)c2cccnc2N3CCCCC3
InChi [?]:
InChI=1/C18H20N4O2/c19-16(23)13-7-2-3-9-15(13)21-18(24)14-8-6-10-20-17(14)22-11-4-1-5-12-22/h2-3,6-10H,1,4-5,11-12H2,(H2,19,23)(H,21,24)
InChi Info:
AuxInfo=1/1/N:22,1,2,21,23,15,6,14,3,16,20,24,5,13,4,7,18,11,9,17,10,19,8,12/E:(4,5)(11,12)/rA:24nCCCCCCCONNCOCCCCNCNCCCCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s4;s10;d11;s11;s13;d14;s15;d16;d13s17;s18;s19;s20;s21;s22;s19s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H20N4O2
All Atoms:44
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.42876
Area:509.433
Solvation:-3.30707
Coulombic:-59.2004
Bond Count [?]
All:26
Single:18
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:324.377
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:2.86
LogP (Chemaxon):2.78

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