N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide

C14H22N2O3 — CID 103946026

IUPACN-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide
SMILESCCC(C)(CCO)NC(=O)CCn1ccccc1=O
InChIInChI=1S/C14H22N2O3/c1-3-14(2,8-11-17)15-12(18)7-10-16-9-5-4-6-13(16)19/h4-6,9,17H,3,7-8,10-11H2,1-2H3,(H,15,18)
InChIKeyRJBKXEPEXRAQRQ-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.91
Rot. Bonds7

About N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide

N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide (PubChem CID 103946026) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide
PubChem CID103946026
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide
SMILESCCC(C)(CCO)NC(=O)CCn1ccccc1=O
InChIInChI=1S/C14H22N2O3/c1-3-14(2,8-11-17)15-12(18)7-10-16-9-5-4-6-13(16)19/h4-6,9,17H,3,7-8,10-11H2,1-2H3,(H,15,18)
InChIKeyRJBKXEPEXRAQRQ-UHFFFAOYSA-N
XLogP0.91
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,3,3-trifluoro-2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]propanoic acid
CID 79791861
2,2,3-trimethyl-3-[3-(2-oxo-1-pyridinyl)propanoylamino]butanoic acid
CID 65266103
N-(1-hydroxy-4,4-dimethylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide
CID 103941143
3-(2-oxo-1-pyridinyl)propanehydrazide
CID 43346089
N-(1-hydroxy-3-methylpentan-3-yl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide
CID 110002544
N-(1-hydroxy-3-methylpentan-3-yl)propanamide
CID 103946136
2,2-dimethyl-3-[3-(2-oxo-1-pyridinyl)propanoylamino]propanamide
CID 86996735
N-(4-acetamidophenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 86979387
N-(1-hydroxy-3-methylpentan-3-yl)-2-(1-methylidene-3-oxoisoindol-2-yl)acetamide
CID 110002043
N-(3-hydroxy-2,2,4-trimethylpentyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 109381038
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 110908908
2-(4-fluorophenyl)sulfanyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
CID 103945789

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide?
The IUPAC name of N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide (CID 103946026) is N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide is CCC(C)(CCO)NC(=O)CCn1ccccc1=O.
What is the InChIKey of N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide?
The InChIKey is RJBKXEPEXRAQRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-3-14(2,8-11-17)15-12(18)7-10-16-9-5-4-6-13(16)19/h4-6,9,17H,3,7-8,10-11H2,1-2H3,(H,15,18).
What are the key properties of N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide?
N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide has a molecular weight of 266.34 g/mol, XLogP of 0.91, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-methylpentan-3-yl)-3-(2-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 103946026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).