4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide

C12H13ClN4O — CID 39853788

IUPAC4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide
SMILESCc1ccnc(NC(=O)c2nn(C)c(C)c2Cl)c1
InChIInChI=1S/C12H13ClN4O/c1-7-4-5-14-9(6-7)15-12(18)11-10(13)8(2)17(3)16-11/h4-6H,1-3H3,(H,14,15,18)
InChIKeySQZAELAOHFQBCN-UHFFFAOYSA-N
MW264.72 g/mol
LogP2.34
Rot. Bonds2

About 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide

4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide (PubChem CID 39853788) has the molecular formula C12H13ClN4O and a molecular weight of 264.72 g/mol. Its IUPAC name is 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide
PubChem CID39853788
Molecular FormulaC12H13ClN4O
Molecular Weight264.72 g/mol
Exact Mass264.08
IUPAC Name4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide
SMILESCc1ccnc(NC(=O)c2nn(C)c(C)c2Cl)c1
InChIInChI=1S/C12H13ClN4O/c1-7-4-5-14-9(6-7)15-12(18)11-10(13)8(2)17(3)16-11/h4-6H,1-3H3,(H,14,15,18)
InChIKeySQZAELAOHFQBCN-UHFFFAOYSA-N
XLogP2.34
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.72
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-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

3-chloro-1-methyl-N-(4-methyl-2-pyridinyl)indole-2-carboxamide
CID 71896592
4-chloro-N-(2,6-dichlorophenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 19266700
4-chloro-N-(3-hydroxyphenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 19266964
3-hydroxy-N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 54861359
4-chloro-1,5-dimethyl-N-(2,3,5,6-tetrafluorophenyl)pyrazole-3-carboxamide
CID 19266677
4-chloro-N-(3-fluorophenyl)-1,5-dimethylpyrazole-3-carboxamide
CID 39853991
2-N,6-N-bis(4-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 4130002
N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 46307927
4-amino-1-methyl-N-(4-methyl-2-pyridinyl)pyrazole-5-carboxamide
CID 65355663
5-amino-1-methyl-N-(4-methyl-2-pyridinyl)pyrazole-4-carboxamide
CID 82547054
N-(4-chloro-2-pyridinyl)-1-methylindazole-3-carboxamide
CID 103123877
N-(4-methyl-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide
CID 136666385

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide?
The IUPAC name of 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide (CID 39853788) is 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide.
What is the SMILES notation for 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide?
The canonical SMILES for 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide is Cc1ccnc(NC(=O)c2nn(C)c(C)c2Cl)c1.
What is the InChIKey of 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide?
The InChIKey is SQZAELAOHFQBCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN4O/c1-7-4-5-14-9(6-7)15-12(18)11-10(13)8(2)17(3)16-11/h4-6H,1-3H3,(H,14,15,18).
What are the key properties of 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide?
4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide has a molecular weight of 264.72 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1,5-dimethyl-N-(4-methyl-2-pyridinyl)pyrazole-3-carboxamide is sourced from PubChem (CID 39853788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).