(4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol

C18H20O3 — CID 114518627

IUPAC(4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol
SMILESCOCc1ccccc1C(O)c1ccc(OC2CC2)cc1
InChIInChI=1S/C18H20O3/c1-20-12-14-4-2-3-5-17(14)18(19)13-6-8-15(9-7-13)21-16-10-11-16/h2-9,16,18-19H,10-12H2,1H3
InChIKeyXMWANVLRVKZBIX-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.46
Rot. Bonds6

About (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol

(4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol (PubChem CID 114518627) has the molecular formula C18H20O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol.

Molecular Properties

Compound Name(4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol
PubChem CID114518627
Molecular FormulaC18H20O3
Molecular Weight284.36 g/mol
Exact Mass284.14
IUPAC Name(4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol
SMILESCOCc1ccccc1C(O)c1ccc(OC2CC2)cc1
InChIInChI=1S/C18H20O3/c1-20-12-14-4-2-3-5-17(14)18(19)13-6-8-15(9-7-13)21-16-10-11-16/h2-9,16,18-19H,10-12H2,1H3
InChIKeyXMWANVLRVKZBIX-UHFFFAOYSA-N
XLogP3.46
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-cyclopropyloxyphenyl)-(4-ethoxyphenyl)methanol
CID 114518502
(4-cyclopropyloxyphenyl)-(2-methoxy-4-methylphenyl)methanol
CID 106791062
1,3-benzodioxol-5-yl-(4-cyclopropyloxyphenyl)methanol
CID 114518527
(4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol
CID 105131446
(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 115838349
1-(4-cyclopropyloxyphenyl)propan-1-ol
CID 114518583
(4-cyclopropyloxyphenyl)-(2-fluoro-4-methylphenyl)methanol
CID 115838353
(2-bromo-4-methylphenyl)-(4-cyclopropyloxyphenyl)methanol
CID 114518704
(4-cyclopropyloxyphenyl)-(2,4-difluoro-5-methylphenyl)methanol
CID 115838370
(4-cyclopropyloxyphenyl)-(4-cyclopropylphenyl)methanol
CID 114518662
(4-cyclopropyloxyphenyl)-(3,4-difluorophenyl)methanol
CID 114518537
(2-amino-3-methoxyphenyl)-(3-cyclopropyloxyphenyl)methanol
CID 107469550

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol?
The IUPAC name of (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol (CID 114518627) is (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol.
What is the SMILES notation for (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol?
The canonical SMILES for (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol is COCc1ccccc1C(O)c1ccc(OC2CC2)cc1.
What is the InChIKey of (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol?
The InChIKey is XMWANVLRVKZBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O3/c1-20-12-14-4-2-3-5-17(14)18(19)13-6-8-15(9-7-13)21-16-10-11-16/h2-9,16,18-19H,10-12H2,1H3.
What are the key properties of (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol?
(4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol has a molecular weight of 284.36 g/mol, XLogP of 3.46, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol is sourced from PubChem (CID 114518627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).