N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide

C15H24N2O3 — CID 109381290

IUPACN-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide
SMILESCC(C)C(O)C(C)(C)CNC(=O)Cn1ccccc1=O
InChIInChI=1S/C15H24N2O3/c1-11(2)14(20)15(3,4)10-16-12(18)9-17-8-6-5-7-13(17)19/h5-8,11,14,20H,9-10H2,1-4H3,(H,16,18)
InChIKeyRUFOVZDXPXBURP-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.01
Rot. Bonds6

About N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide

N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 109381290) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID109381290
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide
SMILESCC(C)C(O)C(C)(C)CNC(=O)Cn1ccccc1=O
InChIInChI=1S/C15H24N2O3/c1-11(2)14(20)15(3,4)10-16-12(18)9-17-8-6-5-7-13(17)19/h5-8,11,14,20H,9-10H2,1-4H3,(H,16,18)
InChIKeyRUFOVZDXPXBURP-UHFFFAOYSA-N
XLogP1.01
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-2,2,4-trimethylpentyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 109381038
N-(3-hydroxy-4-methylpentyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 111460901
N-(2-methyl-4-oxopentan-3-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 62018645
N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 111115969
N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 109380809
N-[(2S)-1-aminopropan-2-yl]-2-(2-oxo-1-pyridinyl)acetamide
CID 120507247
N-(1-methoxypropan-2-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 51174931
1-(3-hydroxy-2,2,4-trimethylpentyl)-3-(1-phenylethyl)urea
CID 109389617
N-(3-methoxypropyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 46418575
N-[2-(4-chlorophenoxy)propyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 71993778
4,4,4-trifluoro-N-(3-hydroxy-2,2,4-trimethylpentyl)-3-phenylbutanamide
CID 109380932
N-(3-hydroxy-2,2,4-trimethylpentyl)-N'-phenyloxamide
CID 109380534

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide (CID 109381290) is N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide is CC(C)C(O)C(C)(C)CNC(=O)Cn1ccccc1=O.
What is the InChIKey of N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is RUFOVZDXPXBURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11(2)14(20)15(3,4)10-16-12(18)9-17-8-6-5-7-13(17)19/h5-8,11,14,20H,9-10H2,1-4H3,(H,16,18).
What are the key properties of N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide?
N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 1.01, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 109381290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).