[(1S,3S)-2,2,3-trimethylcyclopentyl]methanol

C9H18O — CID 11788354

IUPAC[(1S,3S)-2,2,3-trimethylcyclopentyl]methanol
SMILESC[C@H]1CC[C@H](CO)C1(C)C
InChIInChI=1S/C9H18O/c1-7-4-5-8(6-10)9(7,2)3/h7-8,10H,4-6H2,1-3H3/t7-,8+/m0/s1
InChIKeyQCAVMJLHAKYQBN-JGVFFNPUSA-N
MW142.24 g/mol
LogP2.05
Rot. Bonds1

About [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol

[(1S,3S)-2,2,3-trimethylcyclopentyl]methanol (PubChem CID 11788354) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol.

Molecular Properties

Compound Name[(1S,3S)-2,2,3-trimethylcyclopentyl]methanol
PubChem CID11788354
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name[(1S,3S)-2,2,3-trimethylcyclopentyl]methanol
SMILESC[C@H]1CC[C@H](CO)C1(C)C
InChIInChI=1S/C9H18O/c1-7-4-5-8(6-10)9(7,2)3/h7-8,10H,4-6H2,1-3H3/t7-,8+/m0/s1
InChIKeyQCAVMJLHAKYQBN-JGVFFNPUSA-N
XLogP2.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

rac-(1R,2S)-2-tert-butylcyclopentan-1-ol
CID 60085152
2-(3,3-Dimethylbicyclo(2.2.1)hept-2-yl)ethanol
CID 85998
trans-(2-Ethylcyclopentyl)methanol
CID 91697630
Iridodiol
CID 101710
[(1R,3S)-1,2,2,3-tetramethylcyclopentyl]methanol
CID 7054244
(2,2-Dimethylcyclopentyl)methanol
CID 12815287
(3-Ethylcyclopentyl)methanol
CID 22134208
(7,7-Dimethylbicyclo(2.2.1)heptan-1-yl)methanol
CID 53939915
(3,3-Dimethylcyclopentyl)methanol
CID 58806258
3-(2,2-Dimethylcyclopropyl)propan-1-ol
CID 73721210
{Spiro[2.4]heptan-5-yl}methanol
CID 137373898
3-(3-Methylcyclopentyl)propan-1-ol
CID 146742084

Frequently Asked Questions

What is the IUPAC name of [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol?
The IUPAC name of [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol (CID 11788354) is [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol.
What is the SMILES notation for [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol?
The canonical SMILES for [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol is C[C@H]1CC[C@H](CO)C1(C)C.
What is the InChIKey of [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol?
The InChIKey is QCAVMJLHAKYQBN-JGVFFNPUSA-N. The full InChI is InChI=1S/C9H18O/c1-7-4-5-8(6-10)9(7,2)3/h7-8,10H,4-6H2,1-3H3/t7-,8+/m0/s1.
What are the key properties of [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol?
[(1S,3S)-2,2,3-trimethylcyclopentyl]methanol has a molecular weight of 142.24 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,3S)-2,2,3-trimethylcyclopentyl]methanol is sourced from PubChem (CID 11788354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).