N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide

C22H19N3O — CID 55757695

IUPACN,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide
SMILESCc1cc(C(=O)N(C)c2ccc3ccccc3c2)nn1-c1ccccc1
InChIInChI=1S/C22H19N3O/c1-16-14-21(23-25(16)19-10-4-3-5-11-19)22(26)24(2)20-13-12-17-8-6-7-9-18(17)15-20/h3-15H,1-2H3
InChIKeyMXCWALKDTDVGBS-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.61
Rot. Bonds3

About N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide

N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide (PubChem CID 55757695) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide
PubChem CID55757695
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC NameN,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide
SMILESCc1cc(C(=O)N(C)c2ccc3ccccc3c2)nn1-c1ccccc1
InChIInChI=1S/C22H19N3O/c1-16-14-21(23-25(16)19-10-4-3-5-11-19)22(26)24(2)20-13-12-17-8-6-7-9-18(17)15-20/h3-15H,1-2H3
InChIKeyMXCWALKDTDVGBS-UHFFFAOYSA-N
XLogP4.61
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-N,5-dimethyl-1-phenylpyrazole-3-carboxamide
CID 99714138
N-methyl-N-naphthalen-2-yl-4-oxo-3-phenylphthalazine-1-carboxamide
CID 26904232
5-methyl-1-phenylpyrazole-3-carboxylic acid
CID 698388
N-methyl-N-naphthalen-2-ylnaphthalene-2-carboxamide
CID 26904267
5-methyl-1-phenylpyrazole-3-carboxamide
CID 68896199
2-[cyclopropyl-(5-methyl-1-phenylpyrazole-3-carbonyl)amino]acetic acid
CID 119194677
3-[[1-(4-methoxyphenyl)-5-methylpyrazole-3-carbonyl]-methylamino]propanoic acid
CID 120524985
N-[(3-chlorophenyl)methyl]-N,5-dimethyl-1-phenylpyrazole-3-carboxamide
CID 55754908
N,1,3-trimethyl-N-naphthalen-2-ylthieno[3,2-d]pyrazole-5-carboxamide
CID 51312757
4-[methyl(naphthalene-2-carbonyl)amino]benzoic acid
CID 44726898
ethyl 5-methyl-1-phenylpyrazole-3-carboxylate
CID 10900438
N,5-dimethyl-N-naphthalen-2-ylthiophene-2-carboxamide
CID 51146862

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide?
The IUPAC name of N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide (CID 55757695) is N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide.
What is the SMILES notation for N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide?
The canonical SMILES for N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide is Cc1cc(C(=O)N(C)c2ccc3ccccc3c2)nn1-c1ccccc1.
What is the InChIKey of N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide?
The InChIKey is MXCWALKDTDVGBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c1-16-14-21(23-25(16)19-10-4-3-5-11-19)22(26)24(2)20-13-12-17-8-6-7-9-18(17)15-20/h3-15H,1-2H3.
What are the key properties of N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide?
N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-naphthalen-2-yl-1-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 55757695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).