N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide

C17H16N4O2 — CID 58016352

IUPACN-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-n2cc(-c3cnn(C)c3)ccc2=O)c1
InChIInChI=1S/C17H16N4O2/c1-12(22)19-15-4-3-5-16(8-15)21-11-13(6-7-17(21)23)14-9-18-20(2)10-14/h3-11H,1-2H3,(H,19,22)
InChIKeyYKLHXOVFBWXOJD-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.20
Rot. Bonds3

About N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide

N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide (PubChem CID 58016352) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide
PubChem CID58016352
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC NameN-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-n2cc(-c3cnn(C)c3)ccc2=O)c1
InChIInChI=1S/C17H16N4O2/c1-12(22)19-15-4-3-5-16(8-15)21-11-13(6-7-17(21)23)14-9-18-20(2)10-14/h3-11H,1-2H3,(H,19,22)
InChIKeyYKLHXOVFBWXOJD-UHFFFAOYSA-N
XLogP2.20
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-4-phenoxy-1-pyridinyl]phenyl]acetamide
CID 134318102
N-[3-[5-(4-cyanophenyl)-2-oxo-1-pyridinyl]phenyl]acetamide
CID 44544152
N-[3-[5-(1,3-oxazol-2-yl)-2-oxo-1-pyridinyl]phenyl]acetamide
CID 58016345
N-[3-[5-(1-methylindol-5-yl)-2-oxo-1-pyridinyl]phenyl]acetamide
CID 44544272
N-[3-[5-(2-fluorophenyl)-2-oxo-1-pyridinyl]phenyl]acetamide
CID 58016631
5-(1-methylpyrazol-4-yl)-1-pyridin-4-ylpyridin-2-one
CID 58016351
N-[3-(1-methylpyrazol-4-yl)phenyl]-3-oxobutanamide
CID 110477397
methyl N-[3-(1-methylpyrazol-4-yl)phenyl]carbamate
CID 110477766
ethyl 1-(3-acetamidophenyl)-6-oxopyridine-3-carboxylate
CID 167473354
N-[3-(1-methylpyrazol-4-yl)phenyl]pyridine-4-carboxamide
CID 110482049
1-methyl-N-(3-pyrrol-1-ylphenyl)pyrazole-4-carboxamide
CID 110471452
(E)-N-[3-(1-methylpyrazol-4-yl)phenyl]but-2-enamide
CID 110478051

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide?
The IUPAC name of N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide (CID 58016352) is N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide?
The canonical SMILES for N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide is CC(=O)Nc1cccc(-n2cc(-c3cnn(C)c3)ccc2=O)c1.
What is the InChIKey of N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide?
The InChIKey is YKLHXOVFBWXOJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-12(22)19-15-4-3-5-16(8-15)21-11-13(6-7-17(21)23)14-9-18-20(2)10-14/h3-11H,1-2H3,(H,19,22).
What are the key properties of N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide?
N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide has a molecular weight of 308.34 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-(1-methylpyrazol-4-yl)-2-oxo-1-pyridinyl]phenyl]acetamide is sourced from PubChem (CID 58016352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).