[(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol

C10H20O — CID 24798840

IUPAC[(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol
SMILESC[C@H]1[C@H](CO)CC(C)(C)[C@H]1C
InChIInChI=1S/C10H20O/c1-7-8(2)10(3,4)5-9(7)6-11/h7-9,11H,5-6H2,1-4H3/t7-,8+,9+/m1/s1
InChIKeyRXGPBYYNLXIKQT-VGMNWLOBSA-N
MW156.27 g/mol
LogP2.30
Rot. Bonds1

About [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol

[(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol (PubChem CID 24798840) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol.

Molecular Properties

Compound Name[(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol
PubChem CID24798840
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name[(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol
SMILESC[C@H]1[C@H](CO)CC(C)(C)[C@H]1C
InChIInChI=1S/C10H20O/c1-7-8(2)10(3,4)5-9(7)6-11/h7-9,11H,5-6H2,1-4H3/t7-,8+,9+/m1/s1
InChIKeyRXGPBYYNLXIKQT-VGMNWLOBSA-N
XLogP2.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol?
The IUPAC name of [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol (CID 24798840) is [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol.
What is the SMILES notation for [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol?
The canonical SMILES for [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol is C[C@H]1[C@H](CO)CC(C)(C)[C@H]1C.
What is the InChIKey of [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol?
The InChIKey is RXGPBYYNLXIKQT-VGMNWLOBSA-N. The full InChI is InChI=1S/C10H20O/c1-7-8(2)10(3,4)5-9(7)6-11/h7-9,11H,5-6H2,1-4H3/t7-,8+,9+/m1/s1.
What are the key properties of [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol?
[(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol has a molecular weight of 156.27 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R,3S)-2,3,4,4-tetramethylcyclopentyl]methanol is sourced from PubChem (CID 24798840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).