N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide

C18H18N4O2 — CID 100642790

IUPACN-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide
SMILESCc1cnn(-c2ccccc2)c1NC(=O)CCn1ccccc1=O
InChIInChI=1S/C18H18N4O2/c1-14-13-19-22(15-7-3-2-4-8-15)18(14)20-16(23)10-12-21-11-6-5-9-17(21)24/h2-9,11,13H,10,12H2,1H3,(H,20,23)
InChIKeyDVUOBMIGHRJHTA-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.37
Rot. Bonds5

About N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide

N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide (PubChem CID 100642790) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide
PubChem CID100642790
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC NameN-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide
SMILESCc1cnn(-c2ccccc2)c1NC(=O)CCn1ccccc1=O
InChIInChI=1S/C18H18N4O2/c1-14-13-19-22(15-7-3-2-4-8-15)18(14)20-16(23)10-12-21-11-6-5-9-17(21)24/h2-9,11,13H,10,12H2,1H3,(H,20,23)
InChIKeyDVUOBMIGHRJHTA-UHFFFAOYSA-N
XLogP2.37
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-acetamidophenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 86979387
2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide
CID 75468723
N-(5-fluoro-2-methylphenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 86979424
N-(3-chloro-4-methylphenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 86979400
3-(2-oxo-1-pyridinyl)propanehydrazide
CID 43346089
methyl N-[4-[3-(2-oxo-1-pyridinyl)propanoylamino]phenyl]carbamate
CID 87006402
3-methyl-4-[3-(2-oxo-1-pyridinyl)propanoylamino]butanoic acid
CID 81063006
5-[3-(2-oxo-1-pyridinyl)propanoylamino]thiophene-2-carboxylic acid
CID 43474600
N-(4-methyl-1-phenylpyrazol-5-yl)pyridine-3-carboxamide
CID 99818669
4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)-1-phenylpyrazole-3-carboxamide
CID 167751714
ethyl 5-(butanoylamino)-1-phenylpyrazole-4-carboxylate
CID 5054602
N-(4-methyl-1-phenylpyrazol-5-yl)methanesulfonamide
CID 91649217

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide?
The IUPAC name of N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide (CID 100642790) is N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide is Cc1cnn(-c2ccccc2)c1NC(=O)CCn1ccccc1=O.
What is the InChIKey of N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide?
The InChIKey is DVUOBMIGHRJHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-14-13-19-22(15-7-3-2-4-8-15)18(14)20-16(23)10-12-21-11-6-5-9-17(21)24/h2-9,11,13H,10,12H2,1H3,(H,20,23).
What are the key properties of N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide?
N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide has a molecular weight of 322.37 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 100642790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).