3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide

C18H13Cl2N5O — CID 19509973

IUPAC3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide
SMILESCn1c(NC(=O)c2cc(-c3ccc(Cl)cc3Cl)n[nH]2)nc2ccccc21
InChIInChI=1S/C18H13Cl2N5O/c1-25-16-5-3-2-4-13(16)21-18(25)22-17(26)15-9-14(23-24-15)11-7-6-10(19)8-12(11)20/h2-9H,1H3,(H,23,24)(H,21,22,26)
InChIKeyWRCHQWVHOVLRRR-UHFFFAOYSA-N
MW386.24 g/mol
LogP4.52
Rot. Bonds3

About 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide

3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide (PubChem CID 19509973) has the molecular formula C18H13Cl2N5O and a molecular weight of 386.24 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide
PubChem CID19509973
Molecular FormulaC18H13Cl2N5O
Molecular Weight386.24 g/mol
Exact Mass385.05
IUPAC Name3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide
SMILESCn1c(NC(=O)c2cc(-c3ccc(Cl)cc3Cl)n[nH]2)nc2ccccc21
InChIInChI=1S/C18H13Cl2N5O/c1-25-16-5-3-2-4-13(16)21-18(25)22-17(26)15-9-14(23-24-15)11-7-6-10(19)8-12(11)20/h2-9H,1H3,(H,23,24)(H,21,22,26)
InChIKeyWRCHQWVHOVLRRR-UHFFFAOYSA-N
XLogP4.52
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.24
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-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

2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide
CID 35280310
N-(1-benzylpyrazol-4-yl)-3-(2,4-dichlorophenyl)-1H-pyrazole-5-carboxamide
CID 19397544
3-(2,4-dichlorophenyl)-N-(4-ethoxyphenyl)-1H-pyrazole-5-carboxamide
CID 19509972
N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-3-(2,4-dichlorophenyl)-1H-pyrazole-5-carboxamide
CID 19335893
3-(2,4-dichlorophenyl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide
CID 19509948
3-(2,4-dichlorophenyl)-N'-[(2,4-dihydroxyphenyl)methyl]-1H-pyrazole-5-carbohydrazide
CID 134315879
3-(2,4-dichlorophenyl)-N-[1-[(2,6-dichlorophenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide
CID 19395675
N-butan-2-yl-3-(2,4-dichlorophenyl)-1H-pyrazole-5-carboxamide
CID 19510030
N-(2,5-dichlorophenyl)-3-naphthalen-1-yl-1H-pyrazole-5-carboxamide
CID 51046396
3-(2,4-dichlorophenyl)-N-[1-[(3-methylphenyl)methyl]-1,2,4-triazol-3-yl]-1H-pyrazole-5-carboxamide
CID 19510109
3-(2-chlorophenyl)-N-(3,4-difluorophenyl)-1H-pyrazole-5-carboxamide
CID 46920076
1-[(2-bromo-4-chlorophenoxy)methyl]-N-(1-methylbenzimidazol-2-yl)pyrazole-3-carboxamide
CID 19274404

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide (CID 19509973) is 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide is Cn1c(NC(=O)c2cc(-c3ccc(Cl)cc3Cl)n[nH]2)nc2ccccc21.
What is the InChIKey of 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide?
The InChIKey is WRCHQWVHOVLRRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N5O/c1-25-16-5-3-2-4-13(16)21-18(25)22-17(26)15-9-14(23-24-15)11-7-6-10(19)8-12(11)20/h2-9H,1H3,(H,23,24)(H,21,22,26).
What are the key properties of 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide?
3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide has a molecular weight of 386.24 g/mol, XLogP of 4.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 19509973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).