N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide

C14H22N2O2 — CID 38743387

IUPACN-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide
SMILESCCCCCC(=O)NCc1c(C)cc(C)[nH]c1=O
InChIInChI=1S/C14H22N2O2/c1-4-5-6-7-13(17)15-9-12-10(2)8-11(3)16-14(12)18/h8H,4-7,9H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyLMPLOLVUVANRSH-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.19
Rot. Bonds6

About N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide

N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide (PubChem CID 38743387) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide.

Molecular Properties

Compound NameN-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide
PubChem CID38743387
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide
SMILESCCCCCC(=O)NCc1c(C)cc(C)[nH]c1=O
InChIInChI=1S/C14H22N2O2/c1-4-5-6-7-13(17)15-9-12-10(2)8-11(3)16-14(12)18/h8H,4-7,9H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyLMPLOLVUVANRSH-UHFFFAOYSA-N
XLogP2.19
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(2-chlorophenoxy)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]butanamide
CID 52804898
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 27033472
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-phenylacetamide
CID 71901607
3-amino-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]butanamide;hydrochloride
CID 119694321
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 27171008
2-(2,6-dichlorophenyl)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]acetamide
CID 17405202
N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide
CID 4525427
3-(1-benzofuran-2-yl)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]propanamide
CID 32695433
2-methylbutan-2-yl N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]carbamate
CID 126605003
(3S)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-phenylbutanamide
CID 27170074
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31959852
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4-methyl-5-[(Z)-6-[pentyl(propyl)amino]hex-2-en-3-yl]thiophene-3-carboxamide
CID 137383780

Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide?
The IUPAC name of N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide (CID 38743387) is N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide.
What is the SMILES notation for N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide?
The canonical SMILES for N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide is CCCCCC(=O)NCc1c(C)cc(C)[nH]c1=O.
What is the InChIKey of N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide?
The InChIKey is LMPLOLVUVANRSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-5-6-7-13(17)15-9-12-10(2)8-11(3)16-14(12)18/h8H,4-7,9H2,1-3H3,(H,15,17)(H,16,18).
What are the key properties of N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide?
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide has a molecular weight of 250.34 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide is sourced from PubChem (CID 38743387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).