ethane;4-ethyl-3-methyl-1H-pyridin-2-one

C10H17NO — CID 155712799

IUPACethane;4-ethyl-3-methyl-1H-pyridin-2-one
SMILESCC.CCc1cc[nH]c(=O)c1C
InChIInChI=1S/C8H11NO.C2H6/c1-3-7-4-5-9-8(10)6(7)2;1-2/h4-5H,3H2,1-2H3,(H,9,10);1-2H3
InChIKeyHMKOEOSJNHPBKK-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.27
Rot. Bonds1

About ethane;4-ethyl-3-methyl-1H-pyridin-2-one

ethane;4-ethyl-3-methyl-1H-pyridin-2-one (PubChem CID 155712799) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is ethane;4-ethyl-3-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Nameethane;4-ethyl-3-methyl-1H-pyridin-2-one
PubChem CID155712799
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Nameethane;4-ethyl-3-methyl-1H-pyridin-2-one
SMILESCC.CCc1cc[nH]c(=O)c1C
InChIInChI=1S/C8H11NO.C2H6/c1-3-7-4-5-9-8(10)6(7)2;1-2/h4-5H,3H2,1-2H3,(H,9,10);1-2H3
InChIKeyHMKOEOSJNHPBKK-UHFFFAOYSA-N
XLogP2.27
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethyl-3-methyl-1H-pyridin-2-one;2-hydroxybutanedioic acid
CID 175032123
3,4-dimethyl-1H-pyridin-2-one;ethane
CID 177021392
3-methyl-4-propanoyl-1H-pyridin-2-one
CID 10797117
3-methyl-4-propoxy-1H-pyridin-2-one
CID 66739454
3-methyl-4-pentoxy-1H-pyridin-2-one
CID 66739839
2-ethenyl-3-ethyl-1H-pyrrole
CID 144842515
3-hydroxy-4-octadecyl-1H-pyridin-2-one
CID 151285880
5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione
CID 121267063
3-acetyl-4-pentyl-1H-pyridin-2-one
CID 154981968
3-ethyl-2,6-dihydropyrazolo[3,4-c]pyridin-7-one
CID 15832608
(2-ethyl-1H-pyrrol-3-yl)methanol
CID 174935914
5,8-diethyl-1,4-dihydroquinoxaline-2,3-dione
CID 118870848

Frequently Asked Questions

What is the IUPAC name of ethane;4-ethyl-3-methyl-1H-pyridin-2-one?
The IUPAC name of ethane;4-ethyl-3-methyl-1H-pyridin-2-one (CID 155712799) is ethane;4-ethyl-3-methyl-1H-pyridin-2-one.
What is the SMILES notation for ethane;4-ethyl-3-methyl-1H-pyridin-2-one?
The canonical SMILES for ethane;4-ethyl-3-methyl-1H-pyridin-2-one is CC.CCc1cc[nH]c(=O)c1C.
What is the InChIKey of ethane;4-ethyl-3-methyl-1H-pyridin-2-one?
The InChIKey is HMKOEOSJNHPBKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO.C2H6/c1-3-7-4-5-9-8(10)6(7)2;1-2/h4-5H,3H2,1-2H3,(H,9,10);1-2H3.
What are the key properties of ethane;4-ethyl-3-methyl-1H-pyridin-2-one?
ethane;4-ethyl-3-methyl-1H-pyridin-2-one has a molecular weight of 167.25 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethyl-3-methyl-1H-pyridin-2-one is sourced from PubChem (CID 155712799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).