N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

C20H24N4O2 — CID 109152569

IUPACN-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)nc2)cc1
InChIInChI=1S/C20H24N4O2/c1-14-9-11-24(12-10-14)19-8-3-16(13-21-19)20(26)23-18-6-4-17(5-7-18)22-15(2)25/h3-8,13-14H,9-12H2,1-2H3,(H,22,25)(H,23,26)
InChIKeyNAEHJRABIHHVGH-UHFFFAOYSA-N
MW352.44 g/mol
LogP3.53
Rot. Bonds4

About N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 109152569) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID109152569
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC NameN-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)nc2)cc1
InChIInChI=1S/C20H24N4O2/c1-14-9-11-24(12-10-14)19-8-3-16(13-21-19)20(26)23-18-6-4-17(5-7-18)22-15(2)25/h3-8,13-14H,9-12H2,1-2H3,(H,22,25)(H,23,26)
InChIKeyNAEHJRABIHHVGH-UHFFFAOYSA-N
XLogP3.53
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (CID 109152569) is N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is CC(=O)Nc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)nc2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is NAEHJRABIHHVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-14-9-11-24(12-10-14)19-8-3-16(13-21-19)20(26)23-18-6-4-17(5-7-18)22-15(2)25/h3-8,13-14H,9-12H2,1-2H3,(H,22,25)(H,23,26).
What are the key properties of N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 3.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109152569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).