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

C14H21N3O — CID 136545760

IUPAC6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCCc1cccc(C(=O)NC2CCN(C)CC2)n1
InChIInChI=1S/C14H21N3O/c1-3-11-5-4-6-13(15-11)14(18)16-12-7-9-17(2)10-8-12/h4-6,12H,3,7-10H2,1-2H3,(H,16,18)
InChIKeyKJGHJVDTVCZKGV-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.47
Rot. Bonds3

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

6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide (PubChem CID 136545760) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
PubChem CID136545760
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
SMILESCCc1cccc(C(=O)NC2CCN(C)CC2)n1
InChIInChI=1S/C14H21N3O/c1-3-11-5-4-6-13(15-11)14(18)16-12-7-9-17(2)10-8-12/h4-6,12H,3,7-10H2,1-2H3,(H,16,18)
InChIKeyKJGHJVDTVCZKGV-UHFFFAOYSA-N
XLogP1.47
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide?
The IUPAC name of 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide (CID 136545760) is 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide is CCc1cccc(C(=O)NC2CCN(C)CC2)n1.
What is the InChIKey of 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide?
The InChIKey is KJGHJVDTVCZKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-3-11-5-4-6-13(15-11)14(18)16-12-7-9-17(2)10-8-12/h4-6,12H,3,7-10H2,1-2H3,(H,16,18).
What are the key properties of 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide?
6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 136545760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).