Chemical ID: 7518934

COc1ccc(cc1)NC(=O)c2cccnc2N3CCCC3
Chemical ID:
7518934
Name [?]:
N-(4-methoxyphenyl)-2-pyrrolidin-1-yl-pyridine-3-carboxamide
SMILES [?]:
COc1ccc(cc1)NC(=O)c2cccnc2N3CCCC3
InChi [?]:
InChI=1/C17H19N3O2/c1-22-14-8-6-13(7-9-14)19-17(21)15-5-4-10-18-16(15)20-11-2-3-12-20/h4-10H,2-3,11-12H2,1H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,20,21,14,13,5,7,4,8,15,19,22,6,3,12,17,10,16,9,18,11,2/E:(2,3)(6,7)(8,9)(11,12)/rA:22nCOCCCCCCNCOCCCCNCNCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;s18;s19;s20;s18s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H19N3O2
All Atoms:41
Heavy Atoms:22
Chiral Atoms:None
ZAP Information [?]
Total:7.88265
Area:490.576
Solvation:-4.38174
Coulombic:-39.1079
Bond Count [?]
All:24
Single:17
Double:7
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.1
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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