N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide

C13H19N3O2 — CID 107068551

IUPACN-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide
SMILESCc1ccc(O)c(NC(=O)C2NCCCC2C)n1
InChIInChI=1S/C13H19N3O2/c1-8-4-3-7-14-11(8)13(18)16-12-10(17)6-5-9(2)15-12/h5-6,8,11,14,17H,3-4,7H2,1-2H3,(H,15,16,18)
InChIKeyJLEUDYHQFBNRGF-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.42
Rot. Bonds2

About N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide

N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide (PubChem CID 107068551) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide
PubChem CID107068551
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC NameN-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide
SMILESCc1ccc(O)c(NC(=O)C2NCCCC2C)n1
InChIInChI=1S/C13H19N3O2/c1-8-4-3-7-14-11(8)13(18)16-12-10(17)6-5-9(2)15-12/h5-6,8,11,14,17H,3-4,7H2,1-2H3,(H,15,16,18)
InChIKeyJLEUDYHQFBNRGF-UHFFFAOYSA-N
XLogP1.42
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide?
The IUPAC name of N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide (CID 107068551) is N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide is Cc1ccc(O)c(NC(=O)C2NCCCC2C)n1.
What is the InChIKey of N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide?
The InChIKey is JLEUDYHQFBNRGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-8-4-3-7-14-11(8)13(18)16-12-10(17)6-5-9(2)15-12/h5-6,8,11,14,17H,3-4,7H2,1-2H3,(H,15,16,18).
What are the key properties of N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide?
N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.42, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylpiperidine-2-carboxamide is sourced from PubChem (CID 107068551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).