[(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol

C10H18O — CID 15139291

IUPAC[(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol
SMILESCC1=C[C@@H](CO)C(C)(C)[C@@H]1C
InChIInChI=1S/C10H18O/c1-7-5-9(6-11)10(3,4)8(7)2/h5,8-9,11H,6H2,1-4H3/t8-,9+/m1/s1
InChIKeyKMSIDXMGNKQFNQ-BDAKNGLRSA-N
MW154.25 g/mol
LogP2.22
Rot. Bonds1

About [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol

[(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol (PubChem CID 15139291) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol.

Molecular Properties

Compound Name[(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol
PubChem CID15139291
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name[(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol
SMILESCC1=C[C@@H](CO)C(C)(C)[C@@H]1C
InChIInChI=1S/C10H18O/c1-7-5-9(6-11)10(3,4)8(7)2/h5,8-9,11H,6H2,1-4H3/t8-,9+/m1/s1
InChIKeyKMSIDXMGNKQFNQ-BDAKNGLRSA-N
XLogP2.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol?
The IUPAC name of [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol (CID 15139291) is [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol.
What is the SMILES notation for [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol?
The canonical SMILES for [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol is CC1=C[C@@H](CO)C(C)(C)[C@@H]1C.
What is the InChIKey of [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol?
The InChIKey is KMSIDXMGNKQFNQ-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H18O/c1-7-5-9(6-11)10(3,4)8(7)2/h5,8-9,11H,6H2,1-4H3/t8-,9+/m1/s1.
What are the key properties of [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol?
[(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol has a molecular weight of 154.25 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,4R)-3,4,5,5-tetramethylcyclopent-2-en-1-yl]methanol is sourced from PubChem (CID 15139291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).