N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide

C23H22N6O — CID 175087543

IUPACN-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide
SMILESCc1cc(-c2ncc(CNC(=O)n3cc(-c4cccc(C)n4)cn3)cc2C)ccn1
InChIInChI=1S/C23H22N6O/c1-15-9-18(11-25-22(15)19-7-8-24-17(3)10-19)12-26-23(30)29-14-20(13-27-29)21-6-4-5-16(2)28-21/h4-11,13-14H,12H2,1-3H3,(H,26,30)
InChIKeyAISHLHRHPRWZRZ-UHFFFAOYSA-N
MW398.47 g/mol
LogP4.09
Rot. Bonds4

About N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide

N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide (PubChem CID 175087543) has the molecular formula C23H22N6O and a molecular weight of 398.47 g/mol. Its IUPAC name is N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide.

Molecular Properties

Compound NameN-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide
PubChem CID175087543
Molecular FormulaC23H22N6O
Molecular Weight398.47 g/mol
Exact Mass398.19
IUPAC NameN-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide
SMILESCc1cc(-c2ncc(CNC(=O)n3cc(-c4cccc(C)n4)cn3)cc2C)ccn1
InChIInChI=1S/C23H22N6O/c1-15-9-18(11-25-22(15)19-7-8-24-17(3)10-19)12-26-23(30)29-14-20(13-27-29)21-6-4-5-16(2)28-21/h4-11,13-14H,12H2,1-3H3,(H,26,30)
InChIKeyAISHLHRHPRWZRZ-UHFFFAOYSA-N
XLogP4.09
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide with MolForge

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Related Compounds

2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]acetamide
CID 149174065
N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-1-(4-phenyl-1,3-thiazol-2-yl)ethenamine
CID 145324737
N-[[5-methyl-6-(3-methylphenyl)-3-pyridinyl]methyl]-6-(2-methyl-4-pyridinyl)-2,7-naphthyridin-1-amine
CID 118634361
N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-5-(5-methyl-3-pyridinyl)-1,3,4-thiadiazole-2-carboxamide
CID 135335325
methyl 8-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methylamino]imidazo[1,2-a]pyrazine-3-carboxylate
CID 155478844
N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-6-pyrazin-2-ylpyridine-3-carboxamide
CID 56597105
N'-[(E)-2-fluoro-1-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methylamino]but-1-enyl]-N-methylidenemethanimidamide
CID 145293410
2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide
CID 58447768
3-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-5-pyridin-2-yl-2H-1,3,4-thiadiazole-2-carboxamide
CID 166680111
N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-9-oxofluorene-2-carboxamide
CID 134149975
N-[[6-[2-(1,1-difluoroethyl)-4-pyridinyl]-5-methyl-3-pyridinyl]methyl]-6-pyridazin-3-ylpyridine-3-carboxamide
CID 118500228
3-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-1-(3-pyrimidin-2-yl-1H-pyrazol-5-yl)propan-1-one
CID 157430392

Frequently Asked Questions

What is the IUPAC name of N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide?
The IUPAC name of N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide (CID 175087543) is N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide.
What is the SMILES notation for N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide?
The canonical SMILES for N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide is Cc1cc(-c2ncc(CNC(=O)n3cc(-c4cccc(C)n4)cn3)cc2C)ccn1.
What is the InChIKey of N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide?
The InChIKey is AISHLHRHPRWZRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N6O/c1-15-9-18(11-25-22(15)19-7-8-24-17(3)10-19)12-26-23(30)29-14-20(13-27-29)21-6-4-5-16(2)28-21/h4-11,13-14H,12H2,1-3H3,(H,26,30).
What are the key properties of N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide?
N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide has a molecular weight of 398.47 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-4-(6-methyl-2-pyridinyl)pyrazole-1-carboxamide is sourced from PubChem (CID 175087543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).