ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole

C10H17NO — CID 142078831

IUPACethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole
SMILESC=CC1=C(/C=C\C)OCN1.CC
InChIInChI=1S/C8H11NO.C2H6/c1-3-5-8-7(4-2)9-6-10-8;1-2/h3-5,9H,2,6H2,1H3;1-2H3/b5-3-;
InChIKeyOAWVKNIBYMJMAK-FBZPGIPVSA-N
MW167.25 g/mol
LogP2.56
Rot. Bonds2

About ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole

ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole (PubChem CID 142078831) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole.

Molecular Properties

Compound Nameethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole
PubChem CID142078831
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Nameethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole
SMILESC=CC1=C(/C=C\C)OCN1.CC
InChIInChI=1S/C8H11NO.C2H6/c1-3-5-8-7(4-2)9-6-10-8;1-2/h3-5,9H,2,6H2,1H3;1-2H3/b5-3-;
InChIKeyOAWVKNIBYMJMAK-FBZPGIPVSA-N
XLogP2.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole?
The IUPAC name of ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole (CID 142078831) is ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole.
What is the SMILES notation for ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole?
The canonical SMILES for ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole is C=CC1=C(/C=C\C)OCN1.CC.
What is the InChIKey of ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole?
The InChIKey is OAWVKNIBYMJMAK-FBZPGIPVSA-N. The full InChI is InChI=1S/C8H11NO.C2H6/c1-3-5-8-7(4-2)9-6-10-8;1-2/h3-5,9H,2,6H2,1H3;1-2H3/b5-3-;.
What are the key properties of ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole?
ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole has a molecular weight of 167.25 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethenyl-5-[(Z)-prop-1-enyl]-2,3-dihydro-1,3-oxazole is sourced from PubChem (CID 142078831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).