(1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol

C8H16O2 — CID 57255548

IUPAC(1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol
SMILESCC1CC[C@@](O)(C(C)O)C1
InChIInChI=1S/C8H16O2/c1-6-3-4-8(10,5-6)7(2)9/h6-7,9-10H,3-5H2,1-2H3/t6?,7?,8-/m0/s1
InChIKeyHZHSFYMKTNAQNY-RRQHEKLDSA-N
MW144.21 g/mol
LogP0.92
Rot. Bonds1

About (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol

(1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol (PubChem CID 57255548) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol.

Molecular Properties

Compound Name(1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol
PubChem CID57255548
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol
SMILESCC1CC[C@@](O)(C(C)O)C1
InChIInChI=1S/C8H16O2/c1-6-3-4-8(10,5-6)7(2)9/h6-7,9-10H,3-5H2,1-2H3/t6?,7?,8-/m0/s1
InChIKeyHZHSFYMKTNAQNY-RRQHEKLDSA-N
XLogP0.92
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol?
The IUPAC name of (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol (CID 57255548) is (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol.
What is the SMILES notation for (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol?
The canonical SMILES for (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol is CC1CC[C@@](O)(C(C)O)C1.
What is the InChIKey of (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol?
The InChIKey is HZHSFYMKTNAQNY-RRQHEKLDSA-N. The full InChI is InChI=1S/C8H16O2/c1-6-3-4-8(10,5-6)7(2)9/h6-7,9-10H,3-5H2,1-2H3/t6?,7?,8-/m0/s1.
What are the key properties of (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol?
(1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol has a molecular weight of 144.21 g/mol, XLogP of 0.92, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(1-hydroxyethyl)-3-methylcyclopentan-1-ol is sourced from PubChem (CID 57255548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).