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

C10H15NO — CID 58125050

IUPAC3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole
SMILESCc1noc2c1CCC2C(C)C
InChIInChI=1S/C10H15NO/c1-6(2)8-4-5-9-7(3)11-12-10(8)9/h6,8H,4-5H2,1-3H3
InChIKeyVNGKEBZRPWAJKX-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.67
Rot. Bonds1

About 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole

3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole (PubChem CID 58125050) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole.

Molecular Properties

Compound Name3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole
PubChem CID58125050
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole
SMILESCc1noc2c1CCC2C(C)C
InChIInChI=1S/C10H15NO/c1-6(2)8-4-5-9-7(3)11-12-10(8)9/h6,8H,4-5H2,1-3H3
InChIKeyVNGKEBZRPWAJKX-UHFFFAOYSA-N
XLogP2.67
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole?
The IUPAC name of 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole (CID 58125050) is 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole.
What is the SMILES notation for 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole?
The canonical SMILES for 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole is Cc1noc2c1CCC2C(C)C.
What is the InChIKey of 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole?
The InChIKey is VNGKEBZRPWAJKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-6(2)8-4-5-9-7(3)11-12-10(8)9/h6,8H,4-5H2,1-3H3.
What are the key properties of 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole?
3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole has a molecular weight of 165.24 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,2]oxazole is sourced from PubChem (CID 58125050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).