N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide

C17H21N3O — CID 1225696

IUPACN-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide
SMILESCc1ccc(Cn2nc(C)c(NC(=O)C3CC3)c2C)cc1
InChIInChI=1S/C17H21N3O/c1-11-4-6-14(7-5-11)10-20-13(3)16(12(2)19-20)18-17(21)15-8-9-15/h4-7,15H,8-10H2,1-3H3,(H,18,21)
InChIKeyVHLZFEDCQPPQOO-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.21
Rot. Bonds4

About N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide

N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide (PubChem CID 1225696) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide
PubChem CID1225696
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC NameN-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide
SMILESCc1ccc(Cn2nc(C)c(NC(=O)C3CC3)c2C)cc1
InChIInChI=1S/C17H21N3O/c1-11-4-6-14(7-5-11)10-20-13(3)16(12(2)19-20)18-17(21)15-8-9-15/h4-7,15H,8-10H2,1-3H3,(H,18,21)
InChIKeyVHLZFEDCQPPQOO-UHFFFAOYSA-N
XLogP3.21
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Ripazepam
CID 33474
3,5-Dimethyl-1-(phenylmethyl)-1H-pyrazol-4-amine
CID 206697
N-[3-[1-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]triazol-4-yl]phenyl]cyclopropanecarboxamide
CID 150533442
2-(3,5-dimethylpyrazolyl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 856236
N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]benzamide
CID 1247478
2-[5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(2-methylphenyl)acetamide
CID 844032
2,2-dibromo-N-[3,5-dimethyl-1-(4-methylbenzyl)-1H-pyrazol-4-yl]-1-methylcyclopropanecarboxamide
CID 4550187
N-benzyl-4-(3,5-dimethyl-1H-pyrazol-1-yl)-4-oxobutanamide
CID 649887
N-benzyl-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
CID 757109
5-Cyclopropyl-N-(2,5-dimethylphenyl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide
CID 843371
3-(3,5-dimethylpyrazol-1-yl)-N-(3-methylphenyl)propanamide
CID 3236386
N-(2,4-dimethylphenyl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)propanamide
CID 3244387

Frequently Asked Questions

What is the IUPAC name of N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide?
The IUPAC name of N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide (CID 1225696) is N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide is Cc1ccc(Cn2nc(C)c(NC(=O)C3CC3)c2C)cc1.
What is the InChIKey of N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide?
The InChIKey is VHLZFEDCQPPQOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-11-4-6-14(7-5-11)10-20-13(3)16(12(2)19-20)18-17(21)15-8-9-15/h4-7,15H,8-10H2,1-3H3,(H,18,21).
What are the key properties of N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide?
N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide has a molecular weight of 283.38 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]cyclopropanecarboxamide is sourced from PubChem (CID 1225696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).