1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide

C22H27N5O3 — CID 172662831

IUPAC1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide
SMILESCOc1ccc(-n2ccc(C)c(C(=O)N(Cc3cnn(C)c3)CC(C)C)c2=O)cn1
InChIInChI=1S/C22H27N5O3/c1-15(2)12-26(14-17-10-24-25(4)13-17)21(28)20-16(3)8-9-27(22(20)29)18-6-7-19(30-5)23-11-18/h6-11,13,15H,12,14H2,1-5H3
InChIKeyXTGDDSZYMCAHJK-UHFFFAOYSA-N
MW409.49 g/mol
LogP2.58
Rot. Bonds7

About 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide

1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide (PubChem CID 172662831) has the molecular formula C22H27N5O3 and a molecular weight of 409.49 g/mol. Its IUPAC name is 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide
PubChem CID172662831
Molecular FormulaC22H27N5O3
Molecular Weight409.49 g/mol
Exact Mass409.21
IUPAC Name1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide
SMILESCOc1ccc(-n2ccc(C)c(C(=O)N(Cc3cnn(C)c3)CC(C)C)c2=O)cn1
InChIInChI=1S/C22H27N5O3/c1-15(2)12-26(14-17-10-24-25(4)13-17)21(28)20-16(3)8-9-27(22(20)29)18-6-7-19(30-5)23-11-18/h6-11,13,15H,12,14H2,1-5H3
InChIKeyXTGDDSZYMCAHJK-UHFFFAOYSA-N
XLogP2.58
TPSA82.25 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.49
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,4-dihydro-2H-chromen-6-ylmethyl)-1-(6-methoxy-3-pyridinyl)-4-methyl-2-oxopyridine-3-carboxamide
CID 172664352
(2R)-2-imidazol-1-yl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide
CID 126451829
1-(2-methylpropyl)-1-[(1-methylpyrazol-4-yl)methyl]-3-[(3-pyrazol-1-ylphenyl)methyl]urea
CID 119071914
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]propanamide
CID 46998441
1-(2-methylpropyl)-1-[(1-methylpyrazol-4-yl)methyl]-3-[(1S)-1-phenyl-2-pyrazol-1-ylethyl]urea
CID 126433746
1-(3-methylphenyl)-N-[(1-methylpyrazol-4-yl)methyl]-6-oxo-N-propan-2-yl-4,5-dihydropyridazine-3-carboxamide
CID 60540374
2-[2-methylpropyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 132968617
N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide
CID 146148048
1-(1,3-benzodioxol-5-yl)-N-ethyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-2-oxopyridine-3-carboxamide
CID 172672125
2-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]acetamide
CID 124752517
3-amino-N-ethyl-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]butanamide
CID 120503339
N-ethyl-1-(4-fluorophenyl)-4-methyl-N-[[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]methyl]-2-oxopyridine-3-carboxamide
CID 172667244

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide (CID 172662831) is 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide is COc1ccc(-n2ccc(C)c(C(=O)N(Cc3cnn(C)c3)CC(C)C)c2=O)cn1.
What is the InChIKey of 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide?
The InChIKey is XTGDDSZYMCAHJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N5O3/c1-15(2)12-26(14-17-10-24-25(4)13-17)21(28)20-16(3)8-9-27(22(20)29)18-6-7-19(30-5)23-11-18/h6-11,13,15H,12,14H2,1-5H3.
What are the key properties of 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide?
1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide has a molecular weight of 409.49 g/mol, XLogP of 2.58, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-3-pyridinyl)-4-methyl-N-(2-methylpropyl)-N-[(1-methylpyrazol-4-yl)methyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172662831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).