4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide

C19H19N3O3 — CID 7992549

IUPAC4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2nn(-c3ccccc3)cc2OC)cc1
InChIInChI=1S/C19H19N3O3/c1-24-16-10-8-14(9-11-16)12-20-19(23)18-17(25-2)13-22(21-18)15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H,20,23)
InChIKeyRPHQBVJPXKQNGC-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.82
Rot. Bonds6

About 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide

4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide (PubChem CID 7992549) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide
PubChem CID7992549
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide
SMILESCOc1ccc(CNC(=O)c2nn(-c3ccccc3)cc2OC)cc1
InChIInChI=1S/C19H19N3O3/c1-24-16-10-8-14(9-11-16)12-20-19(23)18-17(25-2)13-22(21-18)15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H,20,23)
InChIKeyRPHQBVJPXKQNGC-UHFFFAOYSA-N
XLogP2.82
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-bromo-N-(2-methoxy-5-methylphenyl)-1-methyl-1H-pyrazole-3-carboxamide
CID 712427
N-(4-methoxybenzyl)-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide
CID 5015296
4-methoxy-N-(2-methoxy-5-methylphenyl)-1-phenylpyrazole-3-carboxamide
CID 7992588
4-[3,4-Dimethyl-2-(4-methylphenyl)-7-oxo-2H,6H,7H-pyrazolo[3,4-D]pyridazin-6-YL]-N-[(4-methoxyphenyl)methyl]butanamide
CID 20919914
N-(2-(4-Ethoxybenzamido)ethyl)-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide
CID 46884873
5-(4-methoxybenzyl)-4-oxo-N-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide
CID 1474584
3-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)-1-phenylpyrazole-4-carboxamide
CID 24250013
4-fluoro-1-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]pyrazole-5-carboxamide
CID 162642917
N-[2-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-1H-pyrazole-5-carboxamide
CID 166629984
N-[2-(4-ethoxyphenyl)ethyl]-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide
CID 16193356
4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N~1~-(4-methoxybenzyl)butanamide
CID 16022570
N-(2-methoxybenzyl)-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide
CID 5214848

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide?
The IUPAC name of 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide (CID 7992549) is 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide.
What is the SMILES notation for 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide?
The canonical SMILES for 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide is COc1ccc(CNC(=O)c2nn(-c3ccccc3)cc2OC)cc1.
What is the InChIKey of 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide?
The InChIKey is RPHQBVJPXKQNGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-24-16-10-8-14(9-11-16)12-20-19(23)18-17(25-2)13-22(21-18)15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H,20,23).
What are the key properties of 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide?
4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(4-methoxyphenyl)methyl]-1-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 7992549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).