2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole

C15H17NO — CID 177017145

IUPAC2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole
SMILESCCCc1ccc(-c2coc(C3CC3)n2)cc1
InChIInChI=1S/C15H17NO/c1-2-3-11-4-6-12(7-5-11)14-10-17-15(16-14)13-8-9-13/h4-7,10,13H,2-3,8-9H2,1H3
InChIKeyPIUSRZZBSLLOQX-UHFFFAOYSA-N
MW227.31 g/mol
LogP4.17
Rot. Bonds4

About 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole

2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole (PubChem CID 177017145) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole.

Molecular Properties

Compound Name2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole
PubChem CID177017145
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole
SMILESCCCc1ccc(-c2coc(C3CC3)n2)cc1
InChIInChI=1S/C15H17NO/c1-2-3-11-4-6-12(7-5-11)14-10-17-15(16-14)13-8-9-13/h4-7,10,13H,2-3,8-9H2,1H3
InChIKeyPIUSRZZBSLLOQX-UHFFFAOYSA-N
XLogP4.17
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-4-propyl-1,3-oxazole
CID 89181319
trans-(1S,2S)-2-[4-(2-cyclopropyl-1,3-oxazol-4-yl)phenyl]-1-ethylcyclopropane-1-carboxylic acid
CID 66873202
2-(azetidin-3-yl)-4-(4-methoxyphenyl)-1,3-oxazole
CID 105487768
2-(4-butylphenyl)-4-phenyl-1,3-oxazole
CID 56669361
1-ethyl-4-[4-(4-propylphenyl)cyclohexyl]benzene
CID 140788276
(2R)-2-amino-2-methyl-4-[4-[4-(2-propyl-1,3-oxazol-4-yl)phenyl]phenyl]butan-1-ol
CID 162653390
2-(4-propylphenyl)-5-[2-(4-propylphenyl)ethyl]pyridine
CID 19842005
2,5-bis[4-(4-propylphenyl)cyclohexyl]furan
CID 141384048
3-(4-methoxyphenyl)-6-(4-propylphenyl)pyridazine
CID 14669906
5-cyclohexyl-3-(2-propyl-1,3-oxazol-4-yl)-1,2,4-oxadiazole
CID 139002647
4-[4-(4-propylphenyl)-1,3-thiazol-2-yl]aniline
CID 43667849
2-(4-propylphenyl)quinoline
CID 69251676

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole?
The IUPAC name of 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole (CID 177017145) is 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole.
What is the SMILES notation for 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole?
The canonical SMILES for 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole is CCCc1ccc(-c2coc(C3CC3)n2)cc1.
What is the InChIKey of 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole?
The InChIKey is PIUSRZZBSLLOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-2-3-11-4-6-12(7-5-11)14-10-17-15(16-14)13-8-9-13/h4-7,10,13H,2-3,8-9H2,1H3.
What are the key properties of 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole?
2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole has a molecular weight of 227.31 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(4-propylphenyl)-1,3-oxazole is sourced from PubChem (CID 177017145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).