N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide

C17H15Cl2N3O — CID 11268050

IUPACN-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)C1=CCN(c2ncccc2Cl)CC1
InChIInChI=1S/C17H15Cl2N3O/c18-13-3-5-14(6-4-13)21-17(23)12-7-10-22(11-8-12)16-15(19)2-1-9-20-16/h1-7,9H,8,10-11H2,(H,21,23)
InChIKeyWECMDXJIAXDLHA-UHFFFAOYSA-N
MW348.23 g/mol
LogP4.16
Rot. Bonds3

About N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide

N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide (PubChem CID 11268050) has the molecular formula C17H15Cl2N3O and a molecular weight of 348.23 g/mol. Its IUPAC name is N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide
PubChem CID11268050
Molecular FormulaC17H15Cl2N3O
Molecular Weight348.23 g/mol
Exact Mass347.06
IUPAC NameN-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)C1=CCN(c2ncccc2Cl)CC1
InChIInChI=1S/C17H15Cl2N3O/c18-13-3-5-14(6-4-13)21-17(23)12-7-10-22(11-8-12)16-15(19)2-1-9-20-16/h1-7,9H,8,10-11H2,(H,21,23)
InChIKeyWECMDXJIAXDLHA-UHFFFAOYSA-N
XLogP4.16
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.23
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide (CID 11268050) is N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide is O=C(Nc1ccc(Cl)cc1)C1=CCN(c2ncccc2Cl)CC1.
What is the InChIKey of N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide?
The InChIKey is WECMDXJIAXDLHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15Cl2N3O/c18-13-3-5-14(6-4-13)21-17(23)12-7-10-22(11-8-12)16-15(19)2-1-9-20-16/h1-7,9H,8,10-11H2,(H,21,23).
What are the key properties of N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide?
N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide has a molecular weight of 348.23 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-1-(3-chloro-2-pyridinyl)-3,6-dihydro-2H-pyridine-4-carboxamide is sourced from PubChem (CID 11268050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).