2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide

C13H21N3O2 — CID 79355641

IUPAC2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide
SMILESCc1cc(=O)n(CC(=O)NC(C)C(C)C)cc1N
InChIInChI=1S/C13H21N3O2/c1-8(2)10(4)15-12(17)7-16-6-11(14)9(3)5-13(16)18/h5-6,8,10H,7,14H2,1-4H3,(H,15,17)
InChIKeyHTDPVAJOQKBDTB-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.90
Rot. Bonds4

About 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide

2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide (PubChem CID 79355641) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide
PubChem CID79355641
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide
SMILESCc1cc(=O)n(CC(=O)NC(C)C(C)C)cc1N
InChIInChI=1S/C13H21N3O2/c1-8(2)10(4)15-12(17)7-16-6-11(14)9(3)5-13(16)18/h5-6,8,10H,7,14H2,1-4H3,(H,15,17)
InChIKeyHTDPVAJOQKBDTB-UHFFFAOYSA-N
XLogP0.90
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-methyl-N-propan-2-ylacetamide
CID 79355339
2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylphenyl)acetamide
CID 79354801
1-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]-6-oxopyridine-3-carboxylic acid
CID 61489099
2-(5-amino-2,6-dioxo-3-propylpyrimidin-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 63801340
2-(6-amino-5-methyl-2,3-dihydroindol-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 83212874
2-[5-(dimethylsulfamoyl)-2-oxo-1-pyridinyl]-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 7828878
N-(3-methylbutan-2-yl)-2-(3-methyl-2-oxoimidazol-1-yl)acetamide
CID 116624420
2-(6-aminoindol-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 61489016
5-amino-1-[(4-bromophenyl)methyl]-4-methylpyridin-2-one
CID 79355957
2-(6-bromoindol-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 116621827
2-(2-amino-4-methylphenyl)sulfanyl-N-(3-methylbutan-2-yl)acetamide
CID 43302612
2-(2-amino-3-methylphenyl)sulfanyl-N-(3-methylbutan-2-yl)acetamide
CID 79147255

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide (CID 79355641) is 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide is Cc1cc(=O)n(CC(=O)NC(C)C(C)C)cc1N.
What is the InChIKey of 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is HTDPVAJOQKBDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-8(2)10(4)15-12(17)7-16-6-11(14)9(3)5-13(16)18/h5-6,8,10H,7,14H2,1-4H3,(H,15,17).
What are the key properties of 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide?
2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 251.33 g/mol, XLogP of 0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-4-methyl-2-oxo-1-pyridinyl)-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 79355641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).