1-[(1R,2R)-2-methylcyclopentyl]ethanol

C8H16O — CID 142164375

IUPAC1-[(1R,2R)-2-methylcyclopentyl]ethanol
SMILESCC(O)[C@@H]1CCC[C@H]1C
InChIInChI=1S/C8H16O/c1-6-4-3-5-8(6)7(2)9/h6-9H,3-5H2,1-2H3/t6-,7?,8-/m1/s1
InChIKeyPWNGUKSWPILNCX-OECOWPMFSA-N
MW128.21 g/mol
LogP1.80
Rot. Bonds1

About 1-[(1R,2R)-2-methylcyclopentyl]ethanol

1-[(1R,2R)-2-methylcyclopentyl]ethanol (PubChem CID 142164375) has the molecular formula C8H16O and a molecular weight of 128.21 g/mol. Its IUPAC name is 1-[(1R,2R)-2-methylcyclopentyl]ethanol.

Molecular Properties

Compound Name1-[(1R,2R)-2-methylcyclopentyl]ethanol
PubChem CID142164375
Molecular FormulaC8H16O
Molecular Weight128.21 g/mol
Exact Mass128.12
IUPAC Name1-[(1R,2R)-2-methylcyclopentyl]ethanol
SMILESCC(O)[C@@H]1CCC[C@H]1C
InChIInChI=1S/C8H16O/c1-6-4-3-5-8(6)7(2)9/h6-9H,3-5H2,1-2H3/t6-,7?,8-/m1/s1
InChIKeyPWNGUKSWPILNCX-OECOWPMFSA-N
XLogP1.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.21
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(1R,2R)-2-methylcyclopentyl]ethanol?
The IUPAC name of 1-[(1R,2R)-2-methylcyclopentyl]ethanol (CID 142164375) is 1-[(1R,2R)-2-methylcyclopentyl]ethanol.
What is the SMILES notation for 1-[(1R,2R)-2-methylcyclopentyl]ethanol?
The canonical SMILES for 1-[(1R,2R)-2-methylcyclopentyl]ethanol is CC(O)[C@@H]1CCC[C@H]1C.
What is the InChIKey of 1-[(1R,2R)-2-methylcyclopentyl]ethanol?
The InChIKey is PWNGUKSWPILNCX-OECOWPMFSA-N. The full InChI is InChI=1S/C8H16O/c1-6-4-3-5-8(6)7(2)9/h6-9H,3-5H2,1-2H3/t6-,7?,8-/m1/s1.
What are the key properties of 1-[(1R,2R)-2-methylcyclopentyl]ethanol?
1-[(1R,2R)-2-methylcyclopentyl]ethanol has a molecular weight of 128.21 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R,2R)-2-methylcyclopentyl]ethanol is sourced from PubChem (CID 142164375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).