N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide

C24H25N5O — CID 19473366

IUPACN-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide
SMILESCCn1cc(CNC(=O)c2c(-c3ccccc3)nn(-c3ccccc3)c2C)c(C)n1
InChIInChI=1S/C24H25N5O/c1-4-28-16-20(17(2)26-28)15-25-24(30)22-18(3)29(21-13-9-6-10-14-21)27-23(22)19-11-7-5-8-12-19/h5-14,16H,4,15H2,1-3H3,(H,25,30)
InChIKeyHUQDRGFPDIJZTN-UHFFFAOYSA-N
MW399.50 g/mol
LogP4.30
Rot. Bonds6

About N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide

N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide (PubChem CID 19473366) has the molecular formula C24H25N5O and a molecular weight of 399.50 g/mol. Its IUPAC name is N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide
PubChem CID19473366
Molecular FormulaC24H25N5O
Molecular Weight399.50 g/mol
Exact Mass399.21
IUPAC NameN-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide
SMILESCCn1cc(CNC(=O)c2c(-c3ccccc3)nn(-c3ccccc3)c2C)c(C)n1
InChIInChI=1S/C24H25N5O/c1-4-28-16-20(17(2)26-28)15-25-24(30)22-18(3)29(21-13-9-6-10-14-21)27-23(22)19-11-7-5-8-12-19/h5-14,16H,4,15H2,1-3H3,(H,25,30)
InChIKeyHUQDRGFPDIJZTN-UHFFFAOYSA-N
XLogP4.30
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.50
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide
CID 19473347
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1,3-diphenylpyrazole-4-carboxamide
CID 19281272
5-methyl-1,3-diphenyl-N-[[2-(trifluoromethyl)phenyl]methyl]pyrazole-4-carboxamide
CID 143069575
N-[(4-bromo-1-ethylpyrazol-3-yl)methyl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 19333164
5-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-diphenylpyrazole-4-carboxamide
CID 19473385
N,5-dimethyl-1,3-diphenylpyrazole-4-carboxamide
CID 19473549
N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxoacetamide
CID 24610608
5-methyl-1,3-diphenylpyrazole-4-carboxylic acid
CID 673680
5-methyl-1,3-diphenyl-N-(2-piperidin-1-ylethyl)pyrazole-4-carboxamide
CID 4016241
N-(2-aminoethyl)-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 119382148
5-methyl-1,3-diphenylpyrazole-4-carboxylate
CID 4739263
5-methyl-1,3-diphenyl-N,N-di(propan-2-yl)pyrazole-4-carboxamide
CID 3079315

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide?
The IUPAC name of N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide (CID 19473366) is N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide.
What is the SMILES notation for N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide?
The canonical SMILES for N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide is CCn1cc(CNC(=O)c2c(-c3ccccc3)nn(-c3ccccc3)c2C)c(C)n1.
What is the InChIKey of N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide?
The InChIKey is HUQDRGFPDIJZTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O/c1-4-28-16-20(17(2)26-28)15-25-24(30)22-18(3)29(21-13-9-6-10-14-21)27-23(22)19-11-7-5-8-12-19/h5-14,16H,4,15H2,1-3H3,(H,25,30).
What are the key properties of N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide?
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide has a molecular weight of 399.50 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5-methyl-1,3-diphenylpyrazole-4-carboxamide is sourced from PubChem (CID 19473366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).