(1R)-1-cyclopentyl-1-deuterioethanol

C7H14O — CID 157323248

IUPAC(1R)-1-cyclopentyl-1-deuterioethanol
SMILES[2H][C@](C)(O)C1CCCC1
InChIInChI=1S/C7H14O/c1-6(8)7-4-2-3-5-7/h6-8H,2-5H2,1H3/t6-/m1/s1/i6D
InChIKeyWPCMSUSLCWXTKB-DUVJLBCISA-N
MW115.19 g/mol
LogP1.56
Rot. Bonds1

About (1R)-1-cyclopentyl-1-deuterioethanol

(1R)-1-cyclopentyl-1-deuterioethanol (PubChem CID 157323248) has the molecular formula C7H14O and a molecular weight of 115.19 g/mol. Its IUPAC name is (1R)-1-cyclopentyl-1-deuterioethanol.

Molecular Properties

Compound Name(1R)-1-cyclopentyl-1-deuterioethanol
PubChem CID157323248
Molecular FormulaC7H14O
Molecular Weight115.19 g/mol
Exact Mass115.11
IUPAC Name(1R)-1-cyclopentyl-1-deuterioethanol
SMILES[2H][C@](C)(O)C1CCCC1
InChIInChI=1S/C7H14O/c1-6(8)7-4-2-3-5-7/h6-8H,2-5H2,1H3/t6-/m1/s1/i6D
InChIKeyWPCMSUSLCWXTKB-DUVJLBCISA-N
XLogP1.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.19
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

dicyclopentyl(deuterio)methanol
CID 159152479
2-deuteriopropan-2-ylcyclohexane
CID 153320252
3-cyclobutylbutan-2-ol
CID 54399039
3-cyclododecylbutan-2-ol
CID 10444334
1-cycloheptylpropane-1,2-diol
CID 103452573
(3S)-3-cyclopentyl-3-deuteriobutan-2-one
CID 155929625
2-chloro-1-cyclopentylpropan-1-ol
CID 116863753
1-cyclohexyl-2-cyclopentylethane-1,2-diol
CID 103459295
(2S)-2-amino-1-cyclohexylpropan-1-ol;hydrochloride
CID 126622776
(1S,3R)-1-cyclopentylbutane-1,3-diol
CID 130757763
[(2R)-3-methylbutan-2-yl]cyclopentane
CID 59954478
methane;propan-2-ylcyclotetradecane
CID 159882779

Frequently Asked Questions

What is the IUPAC name of (1R)-1-cyclopentyl-1-deuterioethanol?
The IUPAC name of (1R)-1-cyclopentyl-1-deuterioethanol (CID 157323248) is (1R)-1-cyclopentyl-1-deuterioethanol.
What is the SMILES notation for (1R)-1-cyclopentyl-1-deuterioethanol?
The canonical SMILES for (1R)-1-cyclopentyl-1-deuterioethanol is [2H][C@](C)(O)C1CCCC1.
What is the InChIKey of (1R)-1-cyclopentyl-1-deuterioethanol?
The InChIKey is WPCMSUSLCWXTKB-DUVJLBCISA-N. The full InChI is InChI=1S/C7H14O/c1-6(8)7-4-2-3-5-7/h6-8H,2-5H2,1H3/t6-/m1/s1/i6D.
What are the key properties of (1R)-1-cyclopentyl-1-deuterioethanol?
(1R)-1-cyclopentyl-1-deuterioethanol has a molecular weight of 115.19 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-cyclopentyl-1-deuterioethanol is sourced from PubChem (CID 157323248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).