N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

C18H19Cl2N3O — CID 109152594

IUPACN-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)Nc3ccc(Cl)cc3Cl)cn2)CC1
InChIInChI=1S/C18H19Cl2N3O/c1-12-6-8-23(9-7-12)17-5-2-13(11-21-17)18(24)22-16-4-3-14(19)10-15(16)20/h2-5,10-12H,6-9H2,1H3,(H,22,24)
InChIKeyWLAOFZFAHRDCOE-UHFFFAOYSA-N
MW364.28 g/mol
LogP4.88
Rot. Bonds3

About N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 109152594) has the molecular formula C18H19Cl2N3O and a molecular weight of 364.28 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID109152594
Molecular FormulaC18H19Cl2N3O
Molecular Weight364.28 g/mol
Exact Mass363.09
IUPAC NameN-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)Nc3ccc(Cl)cc3Cl)cn2)CC1
InChIInChI=1S/C18H19Cl2N3O/c1-12-6-8-23(9-7-12)17-5-2-13(11-21-17)18(24)22-16-4-3-14(19)10-15(16)20/h2-5,10-12H,6-9H2,1H3,(H,22,24)
InChIKeyWLAOFZFAHRDCOE-UHFFFAOYSA-N
XLogP4.88
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.28
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (CID 109152594) is N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is CC1CCN(c2ccc(C(=O)Nc3ccc(Cl)cc3Cl)cn2)CC1.
What is the InChIKey of N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is WLAOFZFAHRDCOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2N3O/c1-12-6-8-23(9-7-12)17-5-2-13(11-21-17)18(24)22-16-4-3-14(19)10-15(16)20/h2-5,10-12H,6-9H2,1H3,(H,22,24).
What are the key properties of N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 364.28 g/mol, XLogP of 4.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109152594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).