6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole

C7H9NO — CID 20732320

IUPAC6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole
SMILESCC1CCc2cnoc21
InChIInChI=1S/C7H9NO/c1-5-2-3-6-4-8-9-7(5)6/h4-5H,2-3H2,1H3
InChIKeyWEBGDHOHFPMFGX-UHFFFAOYSA-N
MW123.15 g/mol
LogP1.72
Rot. Bonds

About 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole

6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole (PubChem CID 20732320) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole.

Molecular Properties

Compound Name6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole
PubChem CID20732320
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC Name6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole
SMILESCC1CCc2cnoc21
InChIInChI=1S/C7H9NO/c1-5-2-3-6-4-8-9-7(5)6/h4-5H,2-3H2,1H3
InChIKeyWEBGDHOHFPMFGX-UHFFFAOYSA-N
XLogP1.72
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole?
The IUPAC name of 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole (CID 20732320) is 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole.
What is the SMILES notation for 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole?
The canonical SMILES for 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole is CC1CCc2cnoc21.
What is the InChIKey of 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole?
The InChIKey is WEBGDHOHFPMFGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c1-5-2-3-6-4-8-9-7(5)6/h4-5H,2-3H2,1H3.
What are the key properties of 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole?
6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole has a molecular weight of 123.15 g/mol, XLogP of 1.72, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole is sourced from PubChem (CID 20732320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).