N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide

C23H23N5O — CID 2815260

IUPACN-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
SMILESCCCc1c(C(=O)Nc2cc(-c3ccccc3)nn2C)cnn1-c1ccccc1
InChIInChI=1S/C23H23N5O/c1-3-10-21-19(16-24-28(21)18-13-8-5-9-14-18)23(29)25-22-15-20(26-27(22)2)17-11-6-4-7-12-17/h4-9,11-16H,3,10H2,1-2H3,(H,25,29)
InChIKeyCTTSZVYAFMYVCE-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.48
Rot. Bonds6

About N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide

N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide (PubChem CID 2815260) has the molecular formula C23H23N5O and a molecular weight of 385.47 g/mol. Its IUPAC name is N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
PubChem CID2815260
Molecular FormulaC23H23N5O
Molecular Weight385.47 g/mol
Exact Mass385.19
IUPAC NameN-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
SMILESCCCc1c(C(=O)Nc2cc(-c3ccccc3)nn2C)cnn1-c1ccccc1
InChIInChI=1S/C23H23N5O/c1-3-10-21-19(16-24-28(21)18-13-8-5-9-14-18)23(29)25-22-15-20(26-27(22)2)17-11-6-4-7-12-17/h4-9,11-16H,3,10H2,1-2H3,(H,25,29)
InChIKeyCTTSZVYAFMYVCE-UHFFFAOYSA-N
XLogP4.48
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4,5-dimethoxy-2-[(1-phenyl-5-propylpyrazole-4-carbonyl)amino]benzoate
CID 2811265
N-(1H-indazol-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide
CID 59735133
N-[2-(3-methoxyphenyl)ethyl]-1-phenyl-5-propylpyrazole-4-carboxamide
CID 91554312
N-(3,4-dimethylphenyl)-5-ethyl-1-phenylpyrazole-4-carboxamide
CID 46577913
5-ethyl-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-1-phenylpyrazole-4-carboxamide
CID 55722893
1-benzyl-5-methyl-N-[1-methyl-3-(2-methylphenyl)pyrazol-5-yl]pyrazole-4-carboxamide
CID 99817337
methyl 5-butyl-1-phenylpyrazole-4-carboxylate
CID 129024487
6-(furan-2-yl)-2-oxo-N-(1-phenyl-5-propylpyrazol-4-yl)-1H-pyridine-3-carboxamide
CID 75454165
N-(1,3-diphenylpyrazol-5-yl)-2,5-difluorobenzamide
CID 11383259
(E)-3-(1-phenyl-5-propylpyrazol-4-yl)but-2-en-1-ol
CID 70328749
1-(4-chlorophenyl)-N-(3-methylsulfonylphenyl)-5-propylpyrazole-4-carboxamide
CID 91236728
2-acetyl-N-[4-(5-benzamido-1-methylpyrazol-3-yl)phenyl]benzamide
CID 176857987

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The IUPAC name of N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide (CID 2815260) is N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide.
What is the SMILES notation for N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The canonical SMILES for N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide is CCCc1c(C(=O)Nc2cc(-c3ccccc3)nn2C)cnn1-c1ccccc1.
What is the InChIKey of N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
The InChIKey is CTTSZVYAFMYVCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O/c1-3-10-21-19(16-24-28(21)18-13-8-5-9-14-18)23(29)25-22-15-20(26-27(22)2)17-11-6-4-7-12-17/h4-9,11-16H,3,10H2,1-2H3,(H,25,29).
What are the key properties of N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide?
N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide has a molecular weight of 385.47 g/mol, XLogP of 4.48, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-3-phenylpyrazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide is sourced from PubChem (CID 2815260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).