N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide

C20H20N4O — CID 58242945

IUPACN-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide
SMILESCc1cc(C2CC2)n(-c2ccc(NC(=O)Cc3ccncc3)cc2)n1
InChIInChI=1S/C20H20N4O/c1-14-12-19(16-2-3-16)24(23-14)18-6-4-17(5-7-18)22-20(25)13-15-8-10-21-11-9-15/h4-12,16H,2-3,13H2,1H3,(H,22,25)
InChIKeyDXQSHNGCZLMRQS-UHFFFAOYSA-N
MW332.41 g/mol
LogP3.63
Rot. Bonds5

About N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide

N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide (PubChem CID 58242945) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide
PubChem CID58242945
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC NameN-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide
SMILESCc1cc(C2CC2)n(-c2ccc(NC(=O)Cc3ccncc3)cc2)n1
InChIInChI=1S/C20H20N4O/c1-14-12-19(16-2-3-16)24(23-14)18-6-4-17(5-7-18)22-20(25)13-15-8-10-21-11-9-15/h4-12,16H,2-3,13H2,1H3,(H,22,25)
InChIKeyDXQSHNGCZLMRQS-UHFFFAOYSA-N
XLogP3.63
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-3-ylacetamide;hydrochloride
CID 123743286
N-[6-(5-cyclopropyl-3-methylpyrazol-1-yl)-3-pyridinyl]-2-pyridin-4-ylacetamide
CID 58243034
N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide
CID 58254467
N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-1-methylimidazole-2-carboxamide
CID 58242966
N-[4-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]propanamide
CID 154467833
1-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-3-(4-methyl-1,3-thiazol-5-yl)urea
CID 58243025
N-[4-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]-2-quinolin-6-ylacetamide
CID 52913841
N,2-dipyridin-4-ylacetamide
CID 110468100
N-(3,4-dimethylphenyl)-2-pyridin-4-ylacetamide
CID 110697303
N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide
CID 112532425
N-(4-fluorophenyl)-2-pyridin-4-ylacetamide
CID 110697317
N-(4-methoxyphenyl)-2-pyridin-4-ylacetamide
CID 110697333

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide?
The IUPAC name of N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide (CID 58242945) is N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide?
The canonical SMILES for N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide is Cc1cc(C2CC2)n(-c2ccc(NC(=O)Cc3ccncc3)cc2)n1.
What is the InChIKey of N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide?
The InChIKey is DXQSHNGCZLMRQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c1-14-12-19(16-2-3-16)24(23-14)18-6-4-17(5-7-18)22-20(25)13-15-8-10-21-11-9-15/h4-12,16H,2-3,13H2,1H3,(H,22,25).
What are the key properties of N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide?
N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide has a molecular weight of 332.41 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-cyclopropyl-3-methylpyrazol-1-yl)phenyl]-2-pyridin-4-ylacetamide is sourced from PubChem (CID 58242945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).