[(1R,3S)-3-methylcyclopentyl]methanol

C7H14O — CID 58989841

IUPAC[(1R,3S)-3-methylcyclopentyl]methanol
SMILESC[C@H]1CC[C@@H](CO)C1
InChIInChI=1S/C7H14O/c1-6-2-3-7(4-6)5-8/h6-8H,2-5H2,1H3/t6-,7+/m0/s1
InChIKeyPNZNVGRTAKUKGI-NKWVEPMBSA-N
MW114.19 g/mol
LogP1.41
Rot. Bonds1

About [(1R,3S)-3-methylcyclopentyl]methanol

[(1R,3S)-3-methylcyclopentyl]methanol (PubChem CID 58989841) has the molecular formula C7H14O and a molecular weight of 114.19 g/mol. Its IUPAC name is [(1R,3S)-3-methylcyclopentyl]methanol.

Molecular Properties

Compound Name[(1R,3S)-3-methylcyclopentyl]methanol
PubChem CID58989841
Molecular FormulaC7H14O
Molecular Weight114.19 g/mol
Exact Mass114.10
IUPAC Name[(1R,3S)-3-methylcyclopentyl]methanol
SMILESC[C@H]1CC[C@@H](CO)C1
InChIInChI=1S/C7H14O/c1-6-2-3-7(4-6)5-8/h6-8H,2-5H2,1H3/t6-,7+/m0/s1
InChIKeyPNZNVGRTAKUKGI-NKWVEPMBSA-N
XLogP1.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(1R,3S)-3-methylcyclopentyl]methanol?
The IUPAC name of [(1R,3S)-3-methylcyclopentyl]methanol (CID 58989841) is [(1R,3S)-3-methylcyclopentyl]methanol.
What is the SMILES notation for [(1R,3S)-3-methylcyclopentyl]methanol?
The canonical SMILES for [(1R,3S)-3-methylcyclopentyl]methanol is C[C@H]1CC[C@@H](CO)C1.
What is the InChIKey of [(1R,3S)-3-methylcyclopentyl]methanol?
The InChIKey is PNZNVGRTAKUKGI-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H14O/c1-6-2-3-7(4-6)5-8/h6-8H,2-5H2,1H3/t6-,7+/m0/s1.
What are the key properties of [(1R,3S)-3-methylcyclopentyl]methanol?
[(1R,3S)-3-methylcyclopentyl]methanol has a molecular weight of 114.19 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,3S)-3-methylcyclopentyl]methanol is sourced from PubChem (CID 58989841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).