N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide

C23H19N3O2 — CID 19473579

IUPACN-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2cccc(O)c2)c(-c2ccccc2)nn1-c1ccccc1
InChIInChI=1S/C23H19N3O2/c1-16-21(23(28)24-18-11-8-14-20(27)15-18)22(17-9-4-2-5-10-17)25-26(16)19-12-6-3-7-13-19/h2-15,27H,1H3,(H,24,28)
InChIKeyILENNMPADWDYNT-UHFFFAOYSA-N
MW369.42 g/mol
LogP4.81
Rot. Bonds4

About N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide

N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide (PubChem CID 19473579) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide
PubChem CID19473579
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC NameN-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2cccc(O)c2)c(-c2ccccc2)nn1-c1ccccc1
InChIInChI=1S/C23H19N3O2/c1-16-21(23(28)24-18-11-8-14-20(27)15-18)22(17-9-4-2-5-10-17)25-26(16)19-12-6-3-7-13-19/h2-15,27H,1H3,(H,24,28)
InChIKeyILENNMPADWDYNT-UHFFFAOYSA-N
XLogP4.81
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N,5-dimethyl-1,3-diphenylpyrazole-4-carboxamide
CID 19473549
N-(2,3-dimethylphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide
CID 19473295
5-methyl-N-(4-nitrophenyl)-1,3-diphenylpyrazole-4-carboxamide
CID 19473299
5-methyl-1,3-diphenylpyrazole-4-carboxylic acid
CID 673680
N-[4-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide
CID 998979
N-[3-(2,2-dimethylpropanoylamino)phenyl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 55532044
5-methyl-1,3-diphenylpyrazole-4-carboxylate
CID 4739263
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide
CID 19473347
5-methyl-N-[3-(4-methylphenoxy)-5-nitrophenyl]-1,3-diphenylpyrazole-4-carboxamide
CID 19473414
N-(1-benzyl-4-chloropyrazol-3-yl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide
CID 19473450
5-methyl-1,3-diphenyl-N,N-di(propan-2-yl)pyrazole-4-carboxamide
CID 3079315
N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide
CID 19473510

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide?
The IUPAC name of N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide (CID 19473579) is N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide?
The canonical SMILES for N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide is Cc1c(C(=O)Nc2cccc(O)c2)c(-c2ccccc2)nn1-c1ccccc1.
What is the InChIKey of N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide?
The InChIKey is ILENNMPADWDYNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2/c1-16-21(23(28)24-18-11-8-14-20(27)15-18)22(17-9-4-2-5-10-17)25-26(16)19-12-6-3-7-13-19/h2-15,27H,1H3,(H,24,28).
What are the key properties of N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide?
N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide has a molecular weight of 369.42 g/mol, XLogP of 4.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-5-methyl-1,3-diphenylpyrazole-4-carboxamide is sourced from PubChem (CID 19473579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).