1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol

C18H20O2 — CID 65212692

IUPAC1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol
SMILESOC1(COc2ccc(-c3ccccc3)cc2)CCCC1
InChIInChI=1S/C18H20O2/c19-18(12-4-5-13-18)14-20-17-10-8-16(9-11-17)15-6-2-1-3-7-15/h1-3,6-11,19H,4-5,12-14H2
InChIKeyRPHCEKZLZDKUJD-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.04
Rot. Bonds4

About 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol

1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol (PubChem CID 65212692) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol
PubChem CID65212692
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol
SMILESOC1(COc2ccc(-c3ccccc3)cc2)CCCC1
InChIInChI=1S/C18H20O2/c19-18(12-4-5-13-18)14-20-17-10-8-16(9-11-17)15-6-2-1-3-7-15/h1-3,6-11,19H,4-5,12-14H2
InChIKeyRPHCEKZLZDKUJD-UHFFFAOYSA-N
XLogP4.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol (CID 65212692) is 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol is OC1(COc2ccc(-c3ccccc3)cc2)CCCC1.
What is the InChIKey of 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol?
The InChIKey is RPHCEKZLZDKUJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c19-18(12-4-5-13-18)14-20-17-10-8-16(9-11-17)15-6-2-1-3-7-15/h1-3,6-11,19H,4-5,12-14H2.
What are the key properties of 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol?
1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol has a molecular weight of 268.36 g/mol, XLogP of 4.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-phenylphenoxy)methyl]cyclopentan-1-ol is sourced from PubChem (CID 65212692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).