3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide

C18H16Cl2N4O2 — CID 2449804

IUPAC3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2nc(-n3nc(C)cc3C)ccc2Cl)cc1Cl
InChIInChI=1S/C18H16Cl2N4O2/c1-10-8-11(2)24(23-10)16-7-5-13(19)17(22-16)18(25)21-12-4-6-15(26-3)14(20)9-12/h4-9H,1-3H3,(H,21,25)
InChIKeyBCOBWOZWXNHHDY-UHFFFAOYSA-N
MW391.26 g/mol
LogP4.45
Rot. Bonds4

About 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide

3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide (PubChem CID 2449804) has the molecular formula C18H16Cl2N4O2 and a molecular weight of 391.26 g/mol. Its IUPAC name is 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide
PubChem CID2449804
Molecular FormulaC18H16Cl2N4O2
Molecular Weight391.26 g/mol
Exact Mass390.07
IUPAC Name3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2nc(-n3nc(C)cc3C)ccc2Cl)cc1Cl
InChIInChI=1S/C18H16Cl2N4O2/c1-10-8-11(2)24(23-10)16-7-5-13(19)17(22-16)18(25)21-12-4-6-15(26-3)14(20)9-12/h4-9H,1-3H3,(H,21,25)
InChIKeyBCOBWOZWXNHHDY-UHFFFAOYSA-N
XLogP4.45
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.26
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-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

CID 7424264
CID 7424264
CID 2468983
CID 2468983
CID 1093923
CID 1093923
CID 2429892
CID 2429892
CID 53040785
CID 53040785
CID 53040842
CID 53040842
CID 53040989
CID 53040989
CID 53179891
CID 53179891
CID 71805153
CID 71805153
CID 91628604
CID 91628604
CID 5209873
CID 5209873
CID 53175328
CID 53175328

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide (CID 2449804) is 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide is COc1ccc(NC(=O)c2nc(-n3nc(C)cc3C)ccc2Cl)cc1Cl.
What is the InChIKey of 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide?
The InChIKey is BCOBWOZWXNHHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N4O2/c1-10-8-11(2)24(23-10)16-7-5-13(19)17(22-16)18(25)21-12-4-6-15(26-3)14(20)9-12/h4-9H,1-3H3,(H,21,25).
What are the key properties of 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide?
3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide has a molecular weight of 391.26 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(3-chloro-4-methoxyphenyl)-6-(3,5-dimethylpyrazol-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 2449804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).