4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one

C10H15NO2 — CID 123704697

IUPAC4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one
SMILESCCc1cc(=O)[nH]cc1OC(C)C
InChIInChI=1S/C10H15NO2/c1-4-8-5-10(12)11-6-9(8)13-7(2)3/h5-7H,4H2,1-3H3,(H,11,12)
InChIKeyBKHDJEGZYCZABL-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.72
Rot. Bonds3

About 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one

4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one (PubChem CID 123704697) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one.

Molecular Properties

Compound Name4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one
PubChem CID123704697
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one
SMILESCCc1cc(=O)[nH]cc1OC(C)C
InChIInChI=1S/C10H15NO2/c1-4-8-5-10(12)11-6-9(8)13-7(2)3/h5-7H,4H2,1-3H3,(H,11,12)
InChIKeyBKHDJEGZYCZABL-UHFFFAOYSA-N
XLogP1.72
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 162375189
5-ethyl-4-propyl-1H-pyridin-2-one
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4-ethyl-3-propan-2-yloxypyridine
CID 123491232
1-ethyl-4-(2-methylpropoxy)-2-propan-2-yloxybenzene
CID 123447747
4-fluoro-5-(methoxymethoxy)-1H-pyridin-2-one
CID 58047120
2-[4-chloro-2,5-di(propan-2-yloxy)phenyl]acetic acid
CID 82267978
1-(2-ethyl-4-propan-2-yloxyphenyl)ethanamine
CID 82267415
methyl 2-(5-chloro-2-oxo-1H-pyridin-4-yl)acetate
CID 130656120
2-[(5-acetyl-2-propan-2-yloxyphenyl)methylsulfanyl]-4-hydroxy-1H-pyrimidin-6-one
CID 878331
2-[1-(2-chloro-4-ethyl-5-propan-2-yloxyanilino)-1-oxopropan-2-yl]sulfanylpropanoic acid
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4-ethyl-2-propan-2-yloxyaniline
CID 91557957

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one?
The IUPAC name of 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one (CID 123704697) is 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one.
What is the SMILES notation for 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one?
The canonical SMILES for 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one is CCc1cc(=O)[nH]cc1OC(C)C.
What is the InChIKey of 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one?
The InChIKey is BKHDJEGZYCZABL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-4-8-5-10(12)11-6-9(8)13-7(2)3/h5-7H,4H2,1-3H3,(H,11,12).
What are the key properties of 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one?
4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one has a molecular weight of 181.23 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one is sourced from PubChem (CID 123704697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).