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

C19H22ClN3O2 — CID 109152557

IUPACN-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC(C)CC2)nc1
InChIInChI=1S/C19H22ClN3O2/c1-13-7-9-23(10-8-13)18-6-3-14(12-21-18)19(24)22-16-11-15(20)4-5-17(16)25-2/h3-6,11-13H,7-10H2,1-2H3,(H,22,24)
InChIKeyURIKOUSEUGBAET-UHFFFAOYSA-N
MW359.86 g/mol
LogP4.23
Rot. Bonds4

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

N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 109152557) has the molecular formula C19H22ClN3O2 and a molecular weight of 359.86 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID109152557
Molecular FormulaC19H22ClN3O2
Molecular Weight359.86 g/mol
Exact Mass359.14
IUPAC NameN-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC(C)CC2)nc1
InChIInChI=1S/C19H22ClN3O2/c1-13-7-9-23(10-8-13)18-6-3-14(12-21-18)19(24)22-16-11-15(20)4-5-17(16)25-2/h3-6,11-13H,7-10H2,1-2H3,(H,22,24)
InChIKeyURIKOUSEUGBAET-UHFFFAOYSA-N
XLogP4.23
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.86
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (CID 109152557) is N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is COc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC(C)CC2)nc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is URIKOUSEUGBAET-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O2/c1-13-7-9-23(10-8-13)18-6-3-14(12-21-18)19(24)22-16-11-15(20)4-5-17(16)25-2/h3-6,11-13H,7-10H2,1-2H3,(H,22,24).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 359.86 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109152557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).