5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole

C9H13NO2 — CID 134553698

IUPAC5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole
SMILESCCc1cc(OCC2CC2)on1
InChIInChI=1S/C9H13NO2/c1-2-8-5-9(12-10-8)11-6-7-3-4-7/h5,7H,2-4,6H2,1H3
InChIKeyZSKVHTXRLYFBCR-UHFFFAOYSA-N
MW167.21 g/mol
LogP2.03
Rot. Bonds4

About 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole

5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole (PubChem CID 134553698) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole.

Molecular Properties

Compound Name5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole
PubChem CID134553698
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole
SMILESCCc1cc(OCC2CC2)on1
InChIInChI=1S/C9H13NO2/c1-2-8-5-9(12-10-8)11-6-7-3-4-7/h5,7H,2-4,6H2,1H3
InChIKeyZSKVHTXRLYFBCR-UHFFFAOYSA-N
XLogP2.03
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-tert-butyl-5-(cyclopropylmethoxy)-1,2-oxazole
CID 139460317
2-(cyclopropylmethoxy)-5-ethylpyrazine
CID 177013982
2-(cyclopropylmethoxy)-4-methylfuran
CID 134553696
5-chloro-3-ethyl-1,2-oxazole
CID 55264902
3-ethyl-5-fluoro-1,2-oxazole
CID 155322405
4-(cyclopropylmethoxy)-2-ethyl-1H-pyrimidin-6-one
CID 103240776
N-[[2-(cyclopropylmethoxy)-6-ethyl-4-pyridinyl]methyl]propan-1-amine
CID 113381597
2-(cyclopropylmethoxy)-N-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-4-fluoroaniline
CID 126793239
5-(cyclopropylmethoxymethyl)-2-ethylpyridine
CID 177014000
1-(cyclopropylmethoxy)-4-ethyl-2-methylbenzene
CID 155323138
5-[4-(cyclopropylmethoxy)phenyl]-3-methyl-1,2,4-oxadiazole
CID 91283745
[3-[4-(cyclopropylmethoxy)-3-fluorophenyl]-1,2,4-oxadiazol-5-yl]methanamine
CID 117412205

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole?
The IUPAC name of 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole (CID 134553698) is 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole.
What is the SMILES notation for 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole?
The canonical SMILES for 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole is CCc1cc(OCC2CC2)on1.
What is the InChIKey of 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole?
The InChIKey is ZSKVHTXRLYFBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-2-8-5-9(12-10-8)11-6-7-3-4-7/h5,7H,2-4,6H2,1H3.
What are the key properties of 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole?
5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole has a molecular weight of 167.21 g/mol, XLogP of 2.03, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylmethoxy)-3-ethyl-1,2-oxazole is sourced from PubChem (CID 134553698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).