[(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol

C10H18O — CID 15139297

IUPAC[(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol
SMILESC=C1[C@@H](CO)C[C@H](C)C1(C)C
InChIInChI=1S/C10H18O/c1-7-5-9(6-11)8(2)10(7,3)4/h7,9,11H,2,5-6H2,1,3-4H3/t7-,9+/m0/s1
InChIKeyFZBBFCBJVSACRN-IONNQARKSA-N
MW154.25 g/mol
LogP2.22
Rot. Bonds1

About [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol

[(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol (PubChem CID 15139297) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol.

Molecular Properties

Compound Name[(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol
PubChem CID15139297
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name[(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol
SMILESC=C1[C@@H](CO)C[C@H](C)C1(C)C
InChIInChI=1S/C10H18O/c1-7-5-9(6-11)8(2)10(7,3)4/h7,9,11H,2,5-6H2,1,3-4H3/t7-,9+/m0/s1
InChIKeyFZBBFCBJVSACRN-IONNQARKSA-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'}

Analyze [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol?
The IUPAC name of [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol (CID 15139297) is [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol.
What is the SMILES notation for [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol?
The canonical SMILES for [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol is C=C1[C@@H](CO)C[C@H](C)C1(C)C.
What is the InChIKey of [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol?
The InChIKey is FZBBFCBJVSACRN-IONNQARKSA-N. The full InChI is InChI=1S/C10H18O/c1-7-5-9(6-11)8(2)10(7,3)4/h7,9,11H,2,5-6H2,1,3-4H3/t7-,9+/m0/s1.
What are the key properties of [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol?
[(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]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 [(1S,4S)-3,3,4-trimethyl-2-methylidenecyclopentyl]methanol is sourced from PubChem (CID 15139297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).