4-prop-1-enyl-1,3-oxazolidine

C6H11NO — CID 174386132

IUPAC4-prop-1-enyl-1,3-oxazolidine
SMILESCC=CC1COCN1
InChIInChI=1S/C6H11NO/c1-2-3-6-4-8-5-7-6/h2-3,6-7H,4-5H2,1H3
InChIKeyMFISZHIDGZGKJD-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.51
Rot. Bonds1

About 4-prop-1-enyl-1,3-oxazolidine

4-prop-1-enyl-1,3-oxazolidine (PubChem CID 174386132) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 4-prop-1-enyl-1,3-oxazolidine.

Molecular Properties

Compound Name4-prop-1-enyl-1,3-oxazolidine
PubChem CID174386132
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name4-prop-1-enyl-1,3-oxazolidine
SMILESCC=CC1COCN1
InChIInChI=1S/C6H11NO/c1-2-3-6-4-8-5-7-6/h2-3,6-7H,4-5H2,1H3
InChIKeyMFISZHIDGZGKJD-UHFFFAOYSA-N
XLogP0.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-[(E)-prop-1-enyl]-1,3-oxazolidin-2-one
CID 14840510
(4S)-2,2-dimethyl-4-[(E)-prop-1-enyl]-1,3-oxazolidine
CID 59984611
2,2-Dimethyl-4-vinyl-oxazolidine
CID 89311339
(R)-2,2-dimethyl-4-vinyloxazolidine
CID 89372239
(4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine
CID 124583499
4-(But-1-EN-1-YL)-1,3-oxazolidin-2-one
CID 131241120
(4S)-4-ethenyl-1,3-oxazolidine
CID 151415179
(2R)-2-(methoxymethyl)-2,5-dihydro-1H-pyrrole
CID 174452405
(4R)-4-[(Z)-prop-1-enyl]-1,3-oxazolidin-2-one
CID 55287970
4-[(Z)-but-1-enyl]-1,3-oxazolidin-2-one
CID 55300583
4-But-1-enyl-1,3-oxazolidin-2-one
CID 71428103
2-(methoxymethyl)-2,5-dihydro-1H-pyrrole
CID 130507449

Frequently Asked Questions

What is the IUPAC name of 4-prop-1-enyl-1,3-oxazolidine?
The IUPAC name of 4-prop-1-enyl-1,3-oxazolidine (CID 174386132) is 4-prop-1-enyl-1,3-oxazolidine.
What is the SMILES notation for 4-prop-1-enyl-1,3-oxazolidine?
The canonical SMILES for 4-prop-1-enyl-1,3-oxazolidine is CC=CC1COCN1.
What is the InChIKey of 4-prop-1-enyl-1,3-oxazolidine?
The InChIKey is MFISZHIDGZGKJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-2-3-6-4-8-5-7-6/h2-3,6-7H,4-5H2,1H3.
What are the key properties of 4-prop-1-enyl-1,3-oxazolidine?
4-prop-1-enyl-1,3-oxazolidine has a molecular weight of 113.16 g/mol, XLogP of 0.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-prop-1-enyl-1,3-oxazolidine is sourced from PubChem (CID 174386132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).