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

C20H25N3O — CID 651259

IUPAC6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)NCCc3ccccc3)cn2)CC1
InChIInChI=1S/C20H25N3O/c1-16-10-13-23(14-11-16)19-8-7-18(15-22-19)20(24)21-12-9-17-5-3-2-4-6-17/h2-8,15-16H,9-14H2,1H3,(H,21,24)
InChIKeySGOGXMBPRJTMNR-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.29
Rot. Bonds5

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

6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide (PubChem CID 651259) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide
PubChem CID651259
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)NCCc3ccccc3)cn2)CC1
InChIInChI=1S/C20H25N3O/c1-16-10-13-23(14-11-16)19-8-7-18(15-22-19)20(24)21-12-9-17-5-3-2-4-6-17/h2-8,15-16H,9-14H2,1H3,(H,21,24)
InChIKeySGOGXMBPRJTMNR-UHFFFAOYSA-N
XLogP3.29
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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BPKDi
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CID 135905416
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Frequently Asked Questions

What is the IUPAC name of 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide?
The IUPAC name of 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide (CID 651259) is 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide is CC1CCN(c2ccc(C(=O)NCCc3ccccc3)cn2)CC1.
What is the InChIKey of 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide?
The InChIKey is SGOGXMBPRJTMNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-16-10-13-23(14-11-16)19-8-7-18(15-22-19)20(24)21-12-9-17-5-3-2-4-6-17/h2-8,15-16H,9-14H2,1H3,(H,21,24).
What are the key properties of 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide?
6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylpiperidin-1-yl)-N-(2-phenylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 651259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).