1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide

C13H15N5O2 — CID 47143175

IUPAC1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide
SMILESCNC(=O)Nc1ccc(NC(=O)c2cnn(C)c2)cc1
InChIInChI=1S/C13H15N5O2/c1-14-13(20)17-11-5-3-10(4-6-11)16-12(19)9-7-15-18(2)8-9/h3-8H,1-2H3,(H,16,19)(H2,14,17,20)
InChIKeyVPXZCEVSHBFWIN-UHFFFAOYSA-N
MW273.30 g/mol
LogP1.42
Rot. Bonds3

About 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide

1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide (PubChem CID 47143175) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide
PubChem CID47143175
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC Name1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide
SMILESCNC(=O)Nc1ccc(NC(=O)c2cnn(C)c2)cc1
InChIInChI=1S/C13H15N5O2/c1-14-13(20)17-11-5-3-10(4-6-11)16-12(19)9-7-15-18(2)8-9/h3-8H,1-2H3,(H,16,19)(H2,14,17,20)
InChIKeyVPXZCEVSHBFWIN-UHFFFAOYSA-N
XLogP1.42
TPSA88.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide 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

1-methyl-N-[4-(methylaminomethyl)phenyl]pyrazole-4-carboxamide
CID 106909878
N-[4-(dimethylamino)phenyl]-1-methylpyrazole-4-carboxamide
CID 110695872
N-[4-(hydroxymethyl)phenyl]-1-methylpyrazole-4-carboxamide
CID 64794504
N-[4-(diethylamino)phenyl]-1-methylpyrazole-4-carboxamide
CID 19474486
1-methyl-N-[3-(methylcarbamoyl)phenyl]pyrazole-4-carboxamide
CID 18146246
ethyl 4-[(1-methylpyrazole-4-carbonyl)amino]benzoate
CID 29204718
N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1-methylpyrazole-4-carboxamide
CID 110461808
1-methyl-N-[4-(4-methylpiperidin-1-yl)phenyl]pyrazole-4-carboxamide
CID 9303499
N-(4-bromo-3-chlorophenyl)-1-methylpyrazole-4-carboxamide
CID 103824882
N-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-1-methylpyrazole-4-carboxamide
CID 18128242
N-(3,5-dichloro-4-hydroxyphenyl)-1-methylpyrazole-4-carboxamide
CID 82885113
1-methyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]pyrazole-4-carboxamide
CID 86986258

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide?
The IUPAC name of 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide (CID 47143175) is 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide?
The canonical SMILES for 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide is CNC(=O)Nc1ccc(NC(=O)c2cnn(C)c2)cc1.
What is the InChIKey of 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide?
The InChIKey is VPXZCEVSHBFWIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c1-14-13(20)17-11-5-3-10(4-6-11)16-12(19)9-7-15-18(2)8-9/h3-8H,1-2H3,(H,16,19)(H2,14,17,20).
What are the key properties of 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide?
1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 1.42, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide is sourced from PubChem (CID 47143175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).