1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide

C17H17N5O2 — CID 71797491

IUPAC1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide
SMILESCn1nc(CNC(=O)c2cccn(C)c2=O)cc1-c1ccncc1
InChIInChI=1S/C17H17N5O2/c1-21-9-3-4-14(17(21)24)16(23)19-11-13-10-15(22(2)20-13)12-5-7-18-8-6-12/h3-10H,11H2,1-2H3,(H,19,23)
InChIKeyCPGPFFCMJKBPPX-UHFFFAOYSA-N
MW323.36 g/mol
LogP1.11
Rot. Bonds4

About 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide

1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide (PubChem CID 71797491) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide
PubChem CID71797491
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC Name1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide
SMILESCn1nc(CNC(=O)c2cccn(C)c2=O)cc1-c1ccncc1
InChIInChI=1S/C17H17N5O2/c1-21-9-3-4-14(17(21)24)16(23)19-11-13-10-15(22(2)20-13)12-5-7-18-8-6-12/h3-10H,11H2,1-2H3,(H,19,23)
InChIKeyCPGPFFCMJKBPPX-UHFFFAOYSA-N
XLogP1.11
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[5-(furan-2-yl)-1-methylpyrazol-3-yl]methyl]-1-methyl-2-oxopyridine-3-carboxamide
CID 71797295
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]naphthalene-1-carboxamide
CID 90555005
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide
CID 90554952
N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-1-methyl-2-oxopyridine-3-carboxamide
CID 71808560
1-methyl-2-oxo-N-(pyrazolo[1,5-a]pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 90569423
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]butanamide
CID 90554937
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-(4-phenylphenyl)acetamide
CID 90555066
1-methyl-2-oxo-N-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide
CID 136523952
N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-3-(trifluoromethyl)benzamide
CID 90555037
3-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]butanamide
CID 90554943
2-methoxy-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]acetamide
CID 90554940
2-ethoxy-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]acetamide
CID 90554945

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide (CID 71797491) is 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide is Cn1nc(CNC(=O)c2cccn(C)c2=O)cc1-c1ccncc1.
What is the InChIKey of 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide?
The InChIKey is CPGPFFCMJKBPPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c1-21-9-3-4-14(17(21)24)16(23)19-11-13-10-15(22(2)20-13)12-5-7-18-8-6-12/h3-10H,11H2,1-2H3,(H,19,23).
What are the key properties of 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide?
1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide has a molecular weight of 323.36 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 71797491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).