N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide

C14H22N2O3 — CID 111115969

IUPACN-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide
SMILESCCC(CC)C(O)CNC(=O)Cn1ccccc1=O
InChIInChI=1S/C14H22N2O3/c1-3-11(4-2)12(17)9-15-13(18)10-16-8-6-5-7-14(16)19/h5-8,11-12,17H,3-4,9-10H2,1-2H3,(H,15,18)
InChIKeyAQIAFTBABSESEX-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.76
Rot. Bonds7

About N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide

N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 111115969) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID111115969
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide
SMILESCCC(CC)C(O)CNC(=O)Cn1ccccc1=O
InChIInChI=1S/C14H22N2O3/c1-3-11(4-2)12(17)9-15-13(18)10-16-8-6-5-7-14(16)19/h5-8,11-12,17H,3-4,9-10H2,1-2H3,(H,15,18)
InChIKeyAQIAFTBABSESEX-UHFFFAOYSA-N
XLogP0.76
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 ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-4-methylpentyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 111460901
N-[2-(4-chlorophenoxy)propyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 71993778
N-[2-(3,5-dichlorophenyl)-2-hydroxyethyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 111427460
N-(3-ethyl-2-hydroxypentyl)-2-(2-oxoquinoxalin-1-yl)acetamide
CID 111115882
N-[2-(dimethylamino)-3-phenylpropyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 51175658
N-(3-hydroxy-2,2,4-trimethylpentyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 109381290
N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-pyrazol-1-ylacetamide
CID 90624986
N-[(2S)-1-aminopropan-2-yl]-2-(2-oxo-1-pyridinyl)acetamide
CID 120507247
N-(3-methoxypropyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 46418575
N-(2-methyl-4-oxopentan-3-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 62018645
2-(2-aminophenyl)-N-(3-ethyl-2-hydroxypentyl)acetamide
CID 103833107
N-[2-(2-methylphenyl)ethyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 51177305

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide (CID 111115969) is N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide is CCC(CC)C(O)CNC(=O)Cn1ccccc1=O.
What is the InChIKey of N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is AQIAFTBABSESEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-3-11(4-2)12(17)9-15-13(18)10-16-8-6-5-7-14(16)19/h5-8,11-12,17H,3-4,9-10H2,1-2H3,(H,15,18).
What are the key properties of N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide?
N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 266.34 g/mol, XLogP of 0.76, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-hydroxypentyl)-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 111115969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).