N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide

C21H17N5O2 — CID 163264403

IUPACN-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cc3nccc(-c4ccccc4)n3n2)cc1
InChIInChI=1S/C21H17N5O2/c1-14(27)23-16-7-9-17(10-8-16)24-21(28)18-13-20-22-12-11-19(26(20)25-18)15-5-3-2-4-6-15/h2-13H,1H3,(H,23,27)(H,24,28)
InChIKeySCNGGZFMLIDFBC-UHFFFAOYSA-N
MW371.40 g/mol
LogP3.61
Rot. Bonds4

About N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide

N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 163264403) has the molecular formula C21H17N5O2 and a molecular weight of 371.40 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID163264403
Molecular FormulaC21H17N5O2
Molecular Weight371.40 g/mol
Exact Mass371.14
IUPAC NameN-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cc3nccc(-c4ccccc4)n3n2)cc1
InChIInChI=1S/C21H17N5O2/c1-14(27)23-16-7-9-17(10-8-16)24-21(28)18-13-20-22-12-11-19(26(20)25-18)15-5-3-2-4-6-15/h2-13H,1H3,(H,23,27)(H,24,28)
InChIKeySCNGGZFMLIDFBC-UHFFFAOYSA-N
XLogP3.61
TPSA88.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.40
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-fluorophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 167400677
N-(4-acetamidophenyl)-1-methyl-5-phenylpyrazole-3-carboxamide
CID 110336197
7-(4-fluorophenyl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 4865193
(2S)-2-[[4-[[7-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]benzoyl]amino]-3-phenylpropanoic acid
CID 167035853
N-(3-chloro-4-methoxyphenyl)-7-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 50751543
3-[[7-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]benzoic acid
CID 167035775
7-(3,4-dimethoxyphenyl)-N-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 167400667
7-(3,4-dimethoxyphenyl)-N-(4-pyrrolidin-1-ylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 167400675
N-benzyl-7-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 4866947
N-(4-acetylphenyl)-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3991557
[4-[[7-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]phenyl] (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate
CID 167400669
N-(2,5-difluorophenyl)-7-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 5243772

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 163264403) is N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide is CC(=O)Nc1ccc(NC(=O)c2cc3nccc(-c4ccccc4)n3n2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is SCNGGZFMLIDFBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N5O2/c1-14(27)23-16-7-9-17(10-8-16)24-21(28)18-13-20-22-12-11-19(26(20)25-18)15-5-3-2-4-6-15/h2-13H,1H3,(H,23,27)(H,24,28).
What are the key properties of N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide?
N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 371.40 g/mol, XLogP of 3.61, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-7-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 163264403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).