N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide

C15H25N3O2 — CID 91842188

IUPACN-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide
SMILESCCC(C(=O)NCc1[nH]cc(C)c(=O)c1C)N(C)CC
InChIInChI=1S/C15H25N3O2/c1-6-13(18(5)7-2)15(20)17-9-12-11(4)14(19)10(3)8-16-12/h8,13H,6-7,9H2,1-5H3,(H,16,19)(H,17,20)
InChIKeyNMUVZRZAMLKRLG-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.34
Rot. Bonds6

About N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide

N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide (PubChem CID 91842188) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide.

Molecular Properties

Compound NameN-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide
PubChem CID91842188
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide
SMILESCCC(C(=O)NCc1[nH]cc(C)c(=O)c1C)N(C)CC
InChIInChI=1S/C15H25N3O2/c1-6-13(18(5)7-2)15(20)17-9-12-11(4)14(19)10(3)8-16-12/h8,13H,6-7,9H2,1-5H3,(H,16,19)(H,17,20)
InChIKeyNMUVZRZAMLKRLG-UHFFFAOYSA-N
XLogP1.34
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide?
The IUPAC name of N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide (CID 91842188) is N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide.
What is the SMILES notation for N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide?
The canonical SMILES for N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide is CCC(C(=O)NCc1[nH]cc(C)c(=O)c1C)N(C)CC.
What is the InChIKey of N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide?
The InChIKey is NMUVZRZAMLKRLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-6-13(18(5)7-2)15(20)17-9-12-11(4)14(19)10(3)8-16-12/h8,13H,6-7,9H2,1-5H3,(H,16,19)(H,17,20).
What are the key properties of N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide?
N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide has a molecular weight of 279.38 g/mol, XLogP of 1.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-4-oxo-1H-pyridin-2-yl)methyl]-2-[ethyl(methyl)amino]butanamide is sourced from PubChem (CID 91842188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).