5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide

C19H19N3O2 — CID 110336399

IUPAC5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide
SMILESCOc1cccc(-c2cc(C(=O)N(C)c3ccccc3)nn2C)c1
InChIInChI=1S/C19H19N3O2/c1-21(15-9-5-4-6-10-15)19(23)17-13-18(22(2)20-17)14-8-7-11-16(12-14)24-3/h4-13H,1-3H3
InChIKeyRSRTWBRRPSJMCE-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.37
Rot. Bonds4

About 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide

5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide (PubChem CID 110336399) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide
PubChem CID110336399
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide
SMILESCOc1cccc(-c2cc(C(=O)N(C)c3ccccc3)nn2C)c1
InChIInChI=1S/C19H19N3O2/c1-21(15-9-5-4-6-10-15)19(23)17-13-18(22(2)20-17)14-8-7-11-16(12-14)24-3/h4-13H,1-3H3
InChIKeyRSRTWBRRPSJMCE-UHFFFAOYSA-N
XLogP3.37
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(dimethylamino)phenyl]-5-(3-methoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 110336418
[5-(3-methoxyphenyl)-1-methylpyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone
CID 110336353
5-(3-methoxyphenyl)-1-methyl-N-propan-2-ylpyrazole-3-carboxamide
CID 46171148
methyl 2-[[5-(3-methoxyphenyl)-1-methylpyrazole-3-carbonyl]amino]benzoate
CID 110336415
5-(3-methoxyphenyl)-N-[2-(4-methoxyphenyl)ethyl]-1-methylpyrazole-3-carboxamide
CID 110336374
5-(3-methoxyphenyl)-1,3-dimethylpyrazole
CID 57246578
N-(3-acetylphenyl)-5-(3-methoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 110336411
N-(2-cyanophenyl)-5-(3-methoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 110336427
N,N-diethyl-1-methyl-5-phenylpyrazole-3-carboxamide
CID 110336165
2-[5-(3-methoxyphenyl)tetrazol-2-yl]-N-methyl-N-phenylacetamide
CID 26676736
N-(2-methoxy-5-methylphenyl)-5-(3-methoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 110336407
N,N-diethyl-5-(4-methoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 110336301

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide?
The IUPAC name of 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide (CID 110336399) is 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide.
What is the SMILES notation for 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide?
The canonical SMILES for 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide is COc1cccc(-c2cc(C(=O)N(C)c3ccccc3)nn2C)c1.
What is the InChIKey of 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide?
The InChIKey is RSRTWBRRPSJMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-21(15-9-5-4-6-10-15)19(23)17-13-18(22(2)20-17)14-8-7-11-16(12-14)24-3/h4-13H,1-3H3.
What are the key properties of 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide?
5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 3.37, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxyphenyl)-N,1-dimethyl-N-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 110336399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).