4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide

C11H10Cl2N4O — CID 166167706

IUPAC4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide
SMILESCNC(=O)c1[nH]ncc1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C11H10Cl2N4O/c1-14-11(18)10-8(5-15-17-10)16-9-6(12)3-2-4-7(9)13/h2-5,16H,1H3,(H,14,18)(H,15,17)
InChIKeyPUWCYQADPRBKHI-UHFFFAOYSA-N
MW285.13 g/mol
LogP2.82
Rot. Bonds3

About 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide

4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide (PubChem CID 166167706) has the molecular formula C11H10Cl2N4O and a molecular weight of 285.13 g/mol. Its IUPAC name is 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide
PubChem CID166167706
Molecular FormulaC11H10Cl2N4O
Molecular Weight285.13 g/mol
Exact Mass284.02
IUPAC Name4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide
SMILESCNC(=O)c1[nH]ncc1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C11H10Cl2N4O/c1-14-11(18)10-8(5-15-17-10)16-9-6(12)3-2-4-7(9)13/h2-5,16H,1H3,(H,14,18)(H,15,17)
InChIKeyPUWCYQADPRBKHI-UHFFFAOYSA-N
XLogP2.82
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.13
LogP ≤ 52.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-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

4-(2,6-dichloroanilino)-N-ethyl-1H-pyrazole-5-carboxamide
CID 166167644
4-(2,6-dichloroanilino)-N-[1-[2-[(4-methylcyclodeca-1,3,5,7,9-pentaen-1-yl)iodanuidylamino]-2-oxoethyl]piperidin-4-yl]-1H-pyrazole-5-carboxamide
CID 166167657
N-methyl-4-[[2-(4-phenylphenyl)acetyl]amino]-1H-pyrazole-5-carboxamide
CID 69380891
4-[(2,6-dichlorobenzoyl)amino]-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]-1H-pyrazole-5-carboxamide
CID 166167716
4-amino-N-[2-chloro-6-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxamide
CID 63107427
4-amino-N-(2-chlorophenyl)-1H-pyrazole-5-carboxamide
CID 63107036
4-[(4-ethenylphenyl)sulfonylamino]-N-methyl-1H-pyrazole-5-carboxamide
CID 69380823
3-chloro-2-[(5-methyl-1H-pyrazole-4-carbonyl)amino]benzoic acid
CID 107046486
N-cyclohexyl-4-[(2,6-dichlorobenzoyl)amino]-1H-pyrazole-5-carboxamide;2-methoxyethanol
CID 143263328
1-(2,6-dichlorophenyl)-3-methylurea
CID 3018146
N-(2,6-dichlorophenyl)-3-(methylamino)pyridine-4-carboxamide
CID 105070470
2-[2-(2,6-dichloroanilino)phenyl]acetic acid;hydrate
CID 68653725

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide (CID 166167706) is 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide is CNC(=O)c1[nH]ncc1Nc1c(Cl)cccc1Cl.
What is the InChIKey of 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide?
The InChIKey is PUWCYQADPRBKHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N4O/c1-14-11(18)10-8(5-15-17-10)16-9-6(12)3-2-4-7(9)13/h2-5,16H,1H3,(H,14,18)(H,15,17).
What are the key properties of 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide?
4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide has a molecular weight of 285.13 g/mol, XLogP of 2.82, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dichloroanilino)-N-methyl-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 166167706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).