4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide

C17H14Cl2N4O — CID 24820920

IUPAC4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
SMILESCc1cc(-c2cc(Cl)cc(Cl)c2)cc(C(=O)Nc2ccn(C)n2)n1
InChIInChI=1S/C17H14Cl2N4O/c1-10-5-11(12-6-13(18)9-14(19)7-12)8-15(20-10)17(24)21-16-3-4-23(2)22-16/h3-9H,1-2H3,(H,21,22,24)
InChIKeyKQOMOXBILBDCAK-UHFFFAOYSA-N
MW361.23 g/mol
LogP4.35
Rot. Bonds3

About 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide

4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide (PubChem CID 24820920) has the molecular formula C17H14Cl2N4O and a molecular weight of 361.23 g/mol. Its IUPAC name is 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
PubChem CID24820920
Molecular FormulaC17H14Cl2N4O
Molecular Weight361.23 g/mol
Exact Mass360.05
IUPAC Name4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
SMILESCc1cc(-c2cc(Cl)cc(Cl)c2)cc(C(=O)Nc2ccn(C)n2)n1
InChIInChI=1S/C17H14Cl2N4O/c1-10-5-11(12-6-13(18)9-14(19)7-12)8-15(20-10)17(24)21-16-3-4-23(2)22-16/h3-9H,1-2H3,(H,21,22,24)
InChIKeyKQOMOXBILBDCAK-UHFFFAOYSA-N
XLogP4.35
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.23
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide?
The IUPAC name of 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide (CID 24820920) is 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide is Cc1cc(-c2cc(Cl)cc(Cl)c2)cc(C(=O)Nc2ccn(C)n2)n1.
What is the InChIKey of 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide?
The InChIKey is KQOMOXBILBDCAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N4O/c1-10-5-11(12-6-13(18)9-14(19)7-12)8-15(20-10)17(24)21-16-3-4-23(2)22-16/h3-9H,1-2H3,(H,21,22,24).
What are the key properties of 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide?
4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide has a molecular weight of 361.23 g/mol, XLogP of 4.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dichlorophenyl)-6-methyl-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 24820920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).