(4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol

C17H24O4 — CID 114519169

IUPAC(4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol
SMILESCCOC1(C(O)c2ccc(OC3CC3)cc2)CCOCC1
InChIInChI=1S/C17H24O4/c1-2-20-17(9-11-19-12-10-17)16(18)13-3-5-14(6-4-13)21-15-7-8-15/h3-6,15-16,18H,2,7-12H2,1H3
InChIKeyZXIPPDYYEOLBAE-UHFFFAOYSA-N
MW292.37 g/mol
LogP2.85
Rot. Bonds6

About (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol

(4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol (PubChem CID 114519169) has the molecular formula C17H24O4 and a molecular weight of 292.37 g/mol. Its IUPAC name is (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol.

Molecular Properties

Compound Name(4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol
PubChem CID114519169
Molecular FormulaC17H24O4
Molecular Weight292.37 g/mol
Exact Mass292.17
IUPAC Name(4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol
SMILESCCOC1(C(O)c2ccc(OC3CC3)cc2)CCOCC1
InChIInChI=1S/C17H24O4/c1-2-20-17(9-11-19-12-10-17)16(18)13-3-5-14(6-4-13)21-15-7-8-15/h3-6,15-16,18H,2,7-12H2,1H3
InChIKeyZXIPPDYYEOLBAE-UHFFFAOYSA-N
XLogP2.85
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-tert-butylphenyl)-(4-ethoxyoxan-4-yl)methanol
CID 116754252
(3,4-dichlorophenyl)-(4-ethoxyoxan-4-yl)methanol
CID 116754164
1-(4-cyclopropyloxyphenyl)propan-1-ol
CID 114518583
(1-ethoxy-4-methylcyclohexyl)-(4-fluorophenyl)methanol
CID 116754846
(1-ethoxycyclopentyl)-(4-methylphenyl)methanol
CID 116753072
(4-ethoxyoxan-4-yl)-[3-(trifluoromethyl)phenyl]methanol
CID 116754328
(4-cyclopropyloxyphenyl)-(4-ethoxyphenyl)methanol
CID 114518502
(4-ethoxyoxan-4-yl)-naphthalen-1-ylmethanol
CID 116754309
1-(4-cyclopropyloxyphenyl)-2-ethoxyethanol
CID 114519068
(2,3-difluorophenyl)-(4-ethoxyoxan-4-yl)methanol
CID 116754234
1-(4-cyclopropyloxyphenyl)-2-methylsulfanylethanol
CID 114519028
1-(4-cyclopropyloxyphenyl)-2-(4-methoxyphenyl)ethanol
CID 114519008

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol?
The IUPAC name of (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol (CID 114519169) is (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol.
What is the SMILES notation for (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol?
The canonical SMILES for (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol is CCOC1(C(O)c2ccc(OC3CC3)cc2)CCOCC1.
What is the InChIKey of (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol?
The InChIKey is ZXIPPDYYEOLBAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O4/c1-2-20-17(9-11-19-12-10-17)16(18)13-3-5-14(6-4-13)21-15-7-8-15/h3-6,15-16,18H,2,7-12H2,1H3.
What are the key properties of (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol?
(4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol has a molecular weight of 292.37 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyloxyphenyl)-(4-ethoxyoxan-4-yl)methanol is sourced from PubChem (CID 114519169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).