1-cyclopentyl-2-methoxy-2-phenylethanol

C14H20O2 — CID 116756943

IUPAC1-cyclopentyl-2-methoxy-2-phenylethanol
SMILESCOC(c1ccccc1)C(O)C1CCCC1
InChIInChI=1S/C14H20O2/c1-16-14(12-9-3-2-4-10-12)13(15)11-7-5-6-8-11/h2-4,9-11,13-15H,5-8H2,1H3
InChIKeyZSVWJOAMEOBMOK-UHFFFAOYSA-N
MW220.31 g/mol
LogP2.93
Rot. Bonds4

About 1-cyclopentyl-2-methoxy-2-phenylethanol

1-cyclopentyl-2-methoxy-2-phenylethanol (PubChem CID 116756943) has the molecular formula C14H20O2 and a molecular weight of 220.31 g/mol. Its IUPAC name is 1-cyclopentyl-2-methoxy-2-phenylethanol.

Molecular Properties

Compound Name1-cyclopentyl-2-methoxy-2-phenylethanol
PubChem CID116756943
Molecular FormulaC14H20O2
Molecular Weight220.31 g/mol
Exact Mass220.15
IUPAC Name1-cyclopentyl-2-methoxy-2-phenylethanol
SMILESCOC(c1ccccc1)C(O)C1CCCC1
InChIInChI=1S/C14H20O2/c1-16-14(12-9-3-2-4-10-12)13(15)11-7-5-6-8-11/h2-4,9-11,13-15H,5-8H2,1H3
InChIKeyZSVWJOAMEOBMOK-UHFFFAOYSA-N
XLogP2.93
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-methoxy-2-phenylethanol?
The IUPAC name of 1-cyclopentyl-2-methoxy-2-phenylethanol (CID 116756943) is 1-cyclopentyl-2-methoxy-2-phenylethanol.
What is the SMILES notation for 1-cyclopentyl-2-methoxy-2-phenylethanol?
The canonical SMILES for 1-cyclopentyl-2-methoxy-2-phenylethanol is COC(c1ccccc1)C(O)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-methoxy-2-phenylethanol?
The InChIKey is ZSVWJOAMEOBMOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O2/c1-16-14(12-9-3-2-4-10-12)13(15)11-7-5-6-8-11/h2-4,9-11,13-15H,5-8H2,1H3.
What are the key properties of 1-cyclopentyl-2-methoxy-2-phenylethanol?
1-cyclopentyl-2-methoxy-2-phenylethanol has a molecular weight of 220.31 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-methoxy-2-phenylethanol is sourced from PubChem (CID 116756943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).