(3-cyclopropyloxyphenyl)methanol

C10H12O2 — CID 57336629

IUPAC(3-cyclopropyloxyphenyl)methanol
SMILESOCc1cccc(OC2CC2)c1
InChIInChI=1S/C10H12O2/c11-7-8-2-1-3-10(6-8)12-9-4-5-9/h1-3,6,9,11H,4-5,7H2
InChIKeyPVPIRYFVDRVHKQ-UHFFFAOYSA-N
MW164.20 g/mol
LogP1.72
Rot. Bonds3

About (3-cyclopropyloxyphenyl)methanol

(3-cyclopropyloxyphenyl)methanol (PubChem CID 57336629) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is (3-cyclopropyloxyphenyl)methanol.

Molecular Properties

Compound Name(3-cyclopropyloxyphenyl)methanol
PubChem CID57336629
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name(3-cyclopropyloxyphenyl)methanol
SMILESOCc1cccc(OC2CC2)c1
InChIInChI=1S/C10H12O2/c11-7-8-2-1-3-10(6-8)12-9-4-5-9/h1-3,6,9,11H,4-5,7H2
InChIKeyPVPIRYFVDRVHKQ-UHFFFAOYSA-N
XLogP1.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyloxyphenyl)methanol?
The IUPAC name of (3-cyclopropyloxyphenyl)methanol (CID 57336629) is (3-cyclopropyloxyphenyl)methanol.
What is the SMILES notation for (3-cyclopropyloxyphenyl)methanol?
The canonical SMILES for (3-cyclopropyloxyphenyl)methanol is OCc1cccc(OC2CC2)c1.
What is the InChIKey of (3-cyclopropyloxyphenyl)methanol?
The InChIKey is PVPIRYFVDRVHKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c11-7-8-2-1-3-10(6-8)12-9-4-5-9/h1-3,6,9,11H,4-5,7H2.
What are the key properties of (3-cyclopropyloxyphenyl)methanol?
(3-cyclopropyloxyphenyl)methanol has a molecular weight of 164.20 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyloxyphenyl)methanol is sourced from PubChem (CID 57336629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).