1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine

C123H172N14O10 — CID 159365536

IUPAC1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine
SMILESCC.CC.CC.CC.CC.CN.CN(C)C.CNC.Cc1cccc2c1CCC2n1cccc(C(=O)NC2CCCCC2)c1=O.N#Cc1cccc2c1CCC2n1cccc(C(=O)NC2CCCCC2)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O
InChIInChI=1S/C22H23N3O2.C22H26N2O2.3C21H24N2O2.C3H9N.C2H7N.5C2H6.CH5N/c23-14-15-6-4-9-18-17(15)11-12-20(18)25-13-5-10-19(22(25)27)21(26)24-16-7-2-1-3-8-16;1-15-7-5-10-18-17(15)12-13-20(18)24-14-6-11-19(22(24)26)21(25)23-16-8-3-2-4-9-16;3*24-20(22-16-8-2-1-3-9-16)18-11-6-14-23(21(18)25)19-13-12-15-7-4-5-10-17(15)19;1-4(2)3;1-3-2;6*1-2/h4-6,9-10,13,16,20H,1-3,7-8,11-12H2,(H,24,26);5-7,10-11,14,16,20H,2-4,8-9,12-13H2,1H3,(H,23,25);3*4-7,10-11,14,16,19H,1-3,8-9,12-13H2,(H,22,24);1-3H3;3H,1-2H3;5*1-2H3;2H2,1H3
InChIKeyLJBUKFNKMYFCJN-UHFFFAOYSA-N
MW2006.82 g/mol
LogP22.13
Rot. Bonds15

About 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine

1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine (PubChem CID 159365536) has the molecular formula C123H172N14O10 and a molecular weight of 2006.82 g/mol. Its IUPAC name is 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine.

Molecular Properties

Compound Name1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine
PubChem CID159365536
Molecular FormulaC123H172N14O10
Molecular Weight2006.82 g/mol
Exact Mass2005.34
IUPAC Name1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine
SMILESCC.CC.CC.CC.CC.CN.CN(C)C.CNC.Cc1cccc2c1CCC2n1cccc(C(=O)NC2CCCCC2)c1=O.N#Cc1cccc2c1CCC2n1cccc(C(=O)NC2CCCCC2)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O
InChIInChI=1S/C22H23N3O2.C22H26N2O2.3C21H24N2O2.C3H9N.C2H7N.5C2H6.CH5N/c23-14-15-6-4-9-18-17(15)11-12-20(18)25-13-5-10-19(22(25)27)21(26)24-16-7-2-1-3-8-16;1-15-7-5-10-18-17(15)12-13-20(18)24-14-6-11-19(22(24)26)21(25)23-16-8-3-2-4-9-16;3*24-20(22-16-8-2-1-3-9-16)18-11-6-14-23(21(18)25)19-13-12-15-7-4-5-10-17(15)19;1-4(2)3;1-3-2;6*1-2/h4-6,9-10,13,16,20H,1-3,7-8,11-12H2,(H,24,26);5-7,10-11,14,16,20H,2-4,8-9,12-13H2,1H3,(H,23,25);3*4-7,10-11,14,16,19H,1-3,8-9,12-13H2,(H,22,24);1-3H3;3H,1-2H3;5*1-2H3;2H2,1H3
InChIKeyLJBUKFNKMYFCJN-UHFFFAOYSA-N
XLogP22.13
TPSA320.58 Ų
H-Bond Donors7
H-Bond Acceptors19
Rotatable Bonds15
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002006.82
LogP ≤ 522.13
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1019

Analyze 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine?
The IUPAC name of 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine (CID 159365536) is 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine.
What is the SMILES notation for 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine?
The canonical SMILES for 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine is CC.CC.CC.CC.CC.CN.CN(C)C.CNC.Cc1cccc2c1CCC2n1cccc(C(=O)NC2CCCCC2)c1=O.N#Cc1cccc2c1CCC2n1cccc(C(=O)NC2CCCCC2)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O.O=C(NC1CCCCC1)c1cccn(C2CCc3ccccc32)c1=O.
What is the InChIKey of 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine?
The InChIKey is LJBUKFNKMYFCJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2.C22H26N2O2.3C21H24N2O2.C3H9N.C2H7N.5C2H6.CH5N/c23-14-15-6-4-9-18-17(15)11-12-20(18)25-13-5-10-19(22(25)27)21(26)24-16-7-2-1-3-8-16;1-15-7-5-10-18-17(15)12-13-20(18)24-14-6-11-19(22(24)26)21(25)23-16-8-3-2-4-9-16;3*24-20(22-16-8-2-1-3-9-16)18-11-6-14-23(21(18)25)19-13-12-15-7-4-5-10-17(15)19;1-4(2)3;1-3-2;6*1-2/h4-6,9-10,13,16,20H,1-3,7-8,11-12H2,(H,24,26);5-7,10-11,14,16,20H,2-4,8-9,12-13H2,1H3,(H,23,25);3*4-7,10-11,14,16,19H,1-3,8-9,12-13H2,(H,22,24);1-3H3;3H,1-2H3;5*1-2H3;2H2,1H3.
What are the key properties of 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine?
1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine has a molecular weight of 2006.82 g/mol, XLogP of 22.13, 15 rotatable bonds, 7 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyano-2,3-dihydro-1H-inden-1-yl)-N-cyclohexyl-2-oxopyridine-3-carboxamide;tris(N-cyclohexyl-1-(2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide);N-cyclohexyl-1-(4-methyl-2,3-dihydro-1H-inden-1-yl)-2-oxopyridine-3-carboxamide;N,N-dimethylmethanamine;ethane;methanamine;N-methylmethanamine is sourced from PubChem (CID 159365536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).