(4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one

C8H11NO2 — CID 15420012

IUPAC(4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one
SMILESC=C=C(C)C[C@@H]1COC(=O)N1
InChIInChI=1S/C8H11NO2/c1-3-6(2)4-7-5-11-8(10)9-7/h7H,1,4-5H2,2H3,(H,9,10)/t7-/m1/s1
InChIKeyOGPANICZEHKUNX-SSDOTTSWSA-N
MW153.18 g/mol
LogP1.22
Rot. Bonds2

About (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one

(4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one (PubChem CID 15420012) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one
PubChem CID15420012
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name(4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one
SMILESC=C=C(C)C[C@@H]1COC(=O)N1
InChIInChI=1S/C8H11NO2/c1-3-6(2)4-7-5-11-8(10)9-7/h7H,1,4-5H2,2H3,(H,9,10)/t7-/m1/s1
InChIKeyOGPANICZEHKUNX-SSDOTTSWSA-N
XLogP1.22
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S,5S)-5-ethyl-4-prop-2-enyl-1,3-oxazolidin-2-one
CID 11480568
(4R)-4-buta-2,3-dienyl-1,3-oxazolidin-2-one
CID 14941759
(4S)-4-(3-methylbut-2-enyl)-1,3-oxazolidin-2-one
CID 162410724
(4R)-4-but-3-enyl-1,3-oxazolidin-2-one
CID 640426
4-But-3-enyl-1,3-oxazolidin-2-one
CID 21673738
(4S)-4-(2-methylprop-2-enyl)-1,3-oxazolidin-2-one
CID 57463978
4-(2-Methylprop-2-enyl)-1,3-oxazolidin-2-one
CID 69527292
(4S,5R)-4-but-1-en-2-yl-5-methyl-1,3-oxazolidin-2-one
CID 89043950
(4R)-4-prop-1-en-2-yl-1,3-oxazolidin-2-one
CID 89476713
4-(2-Methylbut-2-enyl)-1,3-oxazolidin-2-one
CID 90830770
5-Propan-2-yl-4-prop-1-en-2-yl-1,3-oxazolidin-2-one
CID 129136998
(4R)-4-(3,3-dimethylbut-1-en-2-yl)-1,3-oxazolidin-2-one
CID 130397247

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one?
The IUPAC name of (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one (CID 15420012) is (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one is C=C=C(C)C[C@@H]1COC(=O)N1.
What is the InChIKey of (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one?
The InChIKey is OGPANICZEHKUNX-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H11NO2/c1-3-6(2)4-7-5-11-8(10)9-7/h7H,1,4-5H2,2H3,(H,9,10)/t7-/m1/s1.
What are the key properties of (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one?
(4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one has a molecular weight of 153.18 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(2-methylbuta-2,3-dienyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 15420012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).