4-cyclopropyl-2,5-dimethyl-1,3-oxazole

C8H11NO — CID 15176134

IUPAC4-cyclopropyl-2,5-dimethyl-1,3-oxazole
SMILESCc1nc(C2CC2)c(C)o1
InChIInChI=1S/C8H11NO/c1-5-8(7-3-4-7)9-6(2)10-5/h7H,3-4H2,1-2H3
InChIKeyKHRFELXONQVTTG-UHFFFAOYSA-N
MW137.18 g/mol
LogP2.17
Rot. Bonds1

About 4-cyclopropyl-2,5-dimethyl-1,3-oxazole

4-cyclopropyl-2,5-dimethyl-1,3-oxazole (PubChem CID 15176134) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 4-cyclopropyl-2,5-dimethyl-1,3-oxazole.

Molecular Properties

Compound Name4-cyclopropyl-2,5-dimethyl-1,3-oxazole
PubChem CID15176134
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name4-cyclopropyl-2,5-dimethyl-1,3-oxazole
SMILESCc1nc(C2CC2)c(C)o1
InChIInChI=1S/C8H11NO/c1-5-8(7-3-4-7)9-6(2)10-5/h7H,3-4H2,1-2H3
InChIKeyKHRFELXONQVTTG-UHFFFAOYSA-N
XLogP2.17
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-2,5-dimethyl-1,3-oxazole?
The IUPAC name of 4-cyclopropyl-2,5-dimethyl-1,3-oxazole (CID 15176134) is 4-cyclopropyl-2,5-dimethyl-1,3-oxazole.
What is the SMILES notation for 4-cyclopropyl-2,5-dimethyl-1,3-oxazole?
The canonical SMILES for 4-cyclopropyl-2,5-dimethyl-1,3-oxazole is Cc1nc(C2CC2)c(C)o1.
What is the InChIKey of 4-cyclopropyl-2,5-dimethyl-1,3-oxazole?
The InChIKey is KHRFELXONQVTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-5-8(7-3-4-7)9-6(2)10-5/h7H,3-4H2,1-2H3.
What are the key properties of 4-cyclopropyl-2,5-dimethyl-1,3-oxazole?
4-cyclopropyl-2,5-dimethyl-1,3-oxazole has a molecular weight of 137.18 g/mol, XLogP of 2.17, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-2,5-dimethyl-1,3-oxazole is sourced from PubChem (CID 15176134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).