N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide

C14H20N2O3 — CID 103623165

IUPACN,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide
SMILESCN(CC1CCCCO1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C14H20N2O3/c1-15-7-6-11(9-13(15)17)14(18)16(2)10-12-5-3-4-8-19-12/h6-7,9,12H,3-5,8,10H2,1-2H3
InChIKeyCEFSGSZVSSUJBH-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.03
Rot. Bonds3

About N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide

N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide (PubChem CID 103623165) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide
PubChem CID103623165
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide
SMILESCN(CC1CCCCO1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C14H20N2O3/c1-15-7-6-11(9-13(15)17)14(18)16(2)10-12-5-3-4-8-19-12/h6-7,9,12H,3-5,8,10H2,1-2H3
InChIKeyCEFSGSZVSSUJBH-UHFFFAOYSA-N
XLogP1.03
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2,2-Dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one
CID 47029077
1-ethyl-4-{[(3S)-3-ethylmorpholin-4-yl]carbonyl}pyridin-2(1H)-one
CID 70747151
N-(2-cyclohexyloxyethyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 75461914
6-methyl-2-oxo-N-(tetrahydro-2H-pyran-2-ylmethyl)-1,2-dihydropyridine-4-carboxamide
CID 86284995
1-(tetrahydro-2H-pyran-2-ylmethyl)-3-(trifluoromethyl)pyridin-2(1H)-one
CID 72927219
1-[[(2S)-oxan-2-yl]methyl]-3-(trifluoromethyl)pyridin-2-one
CID 97207549
1-[[(2R)-oxan-2-yl]methyl]-3-(trifluoromethyl)pyridin-2-one
CID 97207550
2-oxo-1-((tetrahydro-2H-pyran-2-yl)methyl)-1,2-dihydropyridine-3-carbaldehyde
CID 121208413
3-[[ethyl-[[(2S)-oxan-2-yl]methyl]amino]methyl]-1H-pyridin-2-one
CID 29105669
3-[[ethyl-[[(2R)-oxan-2-yl]methyl]amino]methyl]-1H-pyridin-2-one
CID 29105671
3-{[ethyl(tetrahydro-2H-pyran-2-ylmethyl)amino]methyl}-2-pyridinol
CID 45246825
1-Methyl-4-(2-methylmorpholine-4-carbonyl)pyridin-2-one
CID 47155722

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide?
The IUPAC name of N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide (CID 103623165) is N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide?
The canonical SMILES for N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide is CN(CC1CCCCO1)C(=O)c1ccn(C)c(=O)c1.
What is the InChIKey of N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide?
The InChIKey is CEFSGSZVSSUJBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-15-7-6-11(9-13(15)17)14(18)16(2)10-12-5-3-4-8-19-12/h6-7,9,12H,3-5,8,10H2,1-2H3.
What are the key properties of N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide?
N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.03, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-(oxan-2-ylmethyl)-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 103623165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).