N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide

C19H19Cl2N3O2 — CID 109081931

IUPACN-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
SMILESCC1CCN(C(=O)c2cc(C(=O)Nc3c(Cl)cccc3Cl)ccn2)CC1
InChIInChI=1S/C19H19Cl2N3O2/c1-12-6-9-24(10-7-12)19(26)16-11-13(5-8-22-16)18(25)23-17-14(20)3-2-4-15(17)21/h2-5,8,11-12H,6-7,9-10H2,1H3,(H,23,25)
InChIKeyHLANYUNTYPDKEA-UHFFFAOYSA-N
MW392.29 g/mol
LogP4.51
Rot. Bonds3

About N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide

N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide (PubChem CID 109081931) has the molecular formula C19H19Cl2N3O2 and a molecular weight of 392.29 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
PubChem CID109081931
Molecular FormulaC19H19Cl2N3O2
Molecular Weight392.29 g/mol
Exact Mass391.09
IUPAC NameN-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
SMILESCC1CCN(C(=O)c2cc(C(=O)Nc3c(Cl)cccc3Cl)ccn2)CC1
InChIInChI=1S/C19H19Cl2N3O2/c1-12-6-9-24(10-7-12)19(26)16-11-13(5-8-22-16)18(25)23-17-14(20)3-2-4-15(17)21/h2-5,8,11-12H,6-7,9-10H2,1H3,(H,23,25)
InChIKeyHLANYUNTYPDKEA-UHFFFAOYSA-N
XLogP4.51
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.29
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide (CID 109081931) is N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide is CC1CCN(C(=O)c2cc(C(=O)Nc3c(Cl)cccc3Cl)ccn2)CC1.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The InChIKey is HLANYUNTYPDKEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2N3O2/c1-12-6-9-24(10-7-12)19(26)16-11-13(5-8-22-16)18(25)23-17-14(20)3-2-4-15(17)21/h2-5,8,11-12H,6-7,9-10H2,1H3,(H,23,25).
What are the key properties of N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide?
N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide has a molecular weight of 392.29 g/mol, XLogP of 4.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide is sourced from PubChem (CID 109081931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).