N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide

C23H19N3O3 — CID 52650371

IUPACN-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)Nc3ccccc3O)nn2-c2ccccc2)cc1
InChIInChI=1S/C23H19N3O3/c1-29-18-13-11-16(12-14-18)21-15-20(25-26(21)17-7-3-2-4-8-17)23(28)24-19-9-5-6-10-22(19)27/h2-15,27H,1H3,(H,24,28)
InChIKeyRRMVEPNGRHAQKT-UHFFFAOYSA-N
MW385.42 g/mol
LogP4.51
Rot. Bonds5

About N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide

N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide (PubChem CID 52650371) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
PubChem CID52650371
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC NameN-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)Nc3ccccc3O)nn2-c2ccccc2)cc1
InChIInChI=1S/C23H19N3O3/c1-29-18-13-11-16(12-14-18)21-15-20(25-26(21)17-7-3-2-4-8-17)23(28)24-19-9-5-6-10-22(19)27/h2-15,27H,1H3,(H,24,28)
InChIKeyRRMVEPNGRHAQKT-UHFFFAOYSA-N
XLogP4.51
TPSA76.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyethyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
CID 78888374
N'-(2-chlorobenzoyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carbohydrazide
CID 55765038
N-[(4-hydroxy-3-methoxyphenyl)methyl]-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide
CID 60509217
5-(4-methoxyphenyl)-1-phenyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrazole-3-carboxamide
CID 55824547
5-(4-methoxyphenyl)-1-phenyl-N-(2-pyridin-2-ylethyl)pyrazole-3-carboxamide
CID 55775417
5-(4-methoxyphenyl)-N-methyl-1-phenyl-N-propan-2-ylpyrazole-3-carboxamide
CID 166208629
N-[(4-methoxyphenyl)methyl]-1-phenyl-5-pyridin-4-ylpyrazole-3-carboxamide
CID 53002283
1-(4-methoxyphenyl)-5-phenyl-N-(2-propan-2-yltriazol-4-yl)pyrazole-3-carboxamide
CID 157019778
5-(4-methoxyphenyl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-1-phenylpyrazole-3-carboxamide
CID 155947371
5-(4-methoxyphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)-1-phenylpyrazole-3-carboxamide
CID 55775986
N-(2-hydroxyphenyl)-1-(4-methoxyphenyl)pyrazole-3-carboxamide
CID 60572392
[1,5-bis(4-methoxyphenyl)pyrazol-3-yl]-(2-methoxyphenyl)methanone
CID 14871128

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide?
The IUPAC name of N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide (CID 52650371) is N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide?
The canonical SMILES for N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide is COc1ccc(-c2cc(C(=O)Nc3ccccc3O)nn2-c2ccccc2)cc1.
What is the InChIKey of N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide?
The InChIKey is RRMVEPNGRHAQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-29-18-13-11-16(12-14-18)21-15-20(25-26(21)17-7-3-2-4-8-17)23(28)24-19-9-5-6-10-22(19)27/h2-15,27H,1H3,(H,24,28).
What are the key properties of N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide?
N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide has a molecular weight of 385.42 g/mol, XLogP of 4.51, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 52650371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).