ethane;4-ethyl-1,3-oxazolidin-2-one

C7H15NO2 — CID 143842145

IUPACethane;4-ethyl-1,3-oxazolidin-2-one
SMILESCC.CCC1COC(=O)N1
InChIInChI=1S/C5H9NO2.C2H6/c1-2-4-3-8-5(7)6-4;1-2/h4H,2-3H2,1H3,(H,6,7);1-2H3
InChIKeyHWSHDCMHJDZJFI-UHFFFAOYSA-N
MW145.20 g/mol
LogP1.53
Rot. Bonds1

About ethane;4-ethyl-1,3-oxazolidin-2-one

ethane;4-ethyl-1,3-oxazolidin-2-one (PubChem CID 143842145) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is ethane;4-ethyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Nameethane;4-ethyl-1,3-oxazolidin-2-one
PubChem CID143842145
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Nameethane;4-ethyl-1,3-oxazolidin-2-one
SMILESCC.CCC1COC(=O)N1
InChIInChI=1S/C5H9NO2.C2H6/c1-2-4-3-8-5(7)6-4;1-2/h4H,2-3H2,1H3,(H,6,7);1-2H3
InChIKeyHWSHDCMHJDZJFI-UHFFFAOYSA-N
XLogP1.53
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-4-ethyl-1,3-oxazolidin-2-one
CID 7832546
(4R)-4-ethyl-1,3-oxazolidin-2-one
CID 641503
(4R)-4-ethyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one
CID 90284378
(2R)-2-aminobutan-1-ol;(4R)-4-ethyl-1,3-oxazolidin-2-one
CID 159356389
(4R)-4-(2-methylpropyl)-1,3-oxazolidin-2-one
CID 2734862
(4S)-4-(cyclopropylmethyl)-1,3-oxazolidin-2-one
CID 67033996
4-ethyl-5-methyl-1,3-oxazinan-2-one
CID 89458123
(4S)-4-[(4-aminophenyl)methyl]-1,3-oxazolidin-2-one;ethane
CID 143785043
3,14-diethyl-1,12-dioxa-4,15-diazacyclodocosane-5,11,16,22-tetrone
CID 10387757
4-(1,3-dithiolan-2-ylmethyl)-1,3-oxazolidin-2-one
CID 15630906
(4S)-4-(3,3,3-trideuterio-2-hydroxy-2-methylpropyl)-1,3-oxazolidin-2-one
CID 90304699
4-(oxolan-3-ylmethyl)-1,3-oxazolidin-2-one
CID 117158831

Frequently Asked Questions

What is the IUPAC name of ethane;4-ethyl-1,3-oxazolidin-2-one?
The IUPAC name of ethane;4-ethyl-1,3-oxazolidin-2-one (CID 143842145) is ethane;4-ethyl-1,3-oxazolidin-2-one.
What is the SMILES notation for ethane;4-ethyl-1,3-oxazolidin-2-one?
The canonical SMILES for ethane;4-ethyl-1,3-oxazolidin-2-one is CC.CCC1COC(=O)N1.
What is the InChIKey of ethane;4-ethyl-1,3-oxazolidin-2-one?
The InChIKey is HWSHDCMHJDZJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2.C2H6/c1-2-4-3-8-5(7)6-4;1-2/h4H,2-3H2,1H3,(H,6,7);1-2H3.
What are the key properties of ethane;4-ethyl-1,3-oxazolidin-2-one?
ethane;4-ethyl-1,3-oxazolidin-2-one has a molecular weight of 145.20 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 143842145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).