N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide

C15H23N3O3 — CID 77092114

IUPACN-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)NCCN2CCCCC2CO)cc1=O
InChIInChI=1S/C15H23N3O3/c1-17-8-5-12(10-14(17)20)15(21)16-6-9-18-7-3-2-4-13(18)11-19/h5,8,10,13,19H,2-4,6-7,9,11H2,1H3,(H,16,21)
InChIKeySXTUOHAYCGWGKM-UHFFFAOYSA-N
MW293.37 g/mol
LogP-0.04
Rot. Bonds5

About N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 77092114) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID77092114
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)NCCN2CCCCC2CO)cc1=O
InChIInChI=1S/C15H23N3O3/c1-17-8-5-12(10-14(17)20)15(21)16-6-9-18-7-3-2-4-13(18)11-19/h5,8,10,13,19H,2-4,6-7,9,11H2,1H3,(H,16,21)
InChIKeySXTUOHAYCGWGKM-UHFFFAOYSA-N
XLogP-0.04
TPSA74.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(2-hydroxycyclohexyl)piperidin-4-yl]-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 121534806
(2E,4E)-N-(2-hydroxyethyl)-2-methyl-5-piperidin-1-ylpenta-2,4-dienamide
CID 89395564
5-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 43114062
N-(4-hydroxycyclohexyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 43417253
N-(1-hydroxybutan-2-yl)-1-methyl-2-oxopyridine-4-carboxamide
CID 43417871
4-[2-(Hydroxymethyl)piperidine-1-carbonyl]-1-methylpyridin-2-one
CID 43421075
5-[2-(hydroxymethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 43421558
3-[2-(hydroxymethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 43421645
3-[2-(hydroxymethyl)piperidine-1-carbonyl]-4,6-dimethyl-1H-pyridin-2-one
CID 43572809
N-[1-(hydroxymethyl)cyclohexyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 55082507
5-Amino-1-[2-[2-(hydroxymethyl)piperidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 55118392
N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 60960113

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 77092114) is N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)NCCN2CCCCC2CO)cc1=O.
What is the InChIKey of N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is SXTUOHAYCGWGKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-17-8-5-12(10-14(17)20)15(21)16-6-9-18-7-3-2-4-13(18)11-19/h5,8,10,13,19H,2-4,6-7,9,11H2,1H3,(H,16,21).
What are the key properties of N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 293.37 g/mol, XLogP of -0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(hydroxymethyl)piperidin-1-yl]ethyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 77092114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).