2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol

C10H18O — CID 11367124

IUPAC2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol
SMILESC[C@H]1CC=C(C(C)(C)O)CC1
InChIInChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h6,8,11H,4-5,7H2,1-3H3/t8-/m0/s1
InChIKeyHMXMWOXFKFLOGK-QMMMGPOBSA-N
MW154.25 g/mol
LogP2.50
Rot. Bonds1

About 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol

2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol (PubChem CID 11367124) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol.

Molecular Properties

Compound Name2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol
PubChem CID11367124
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol
SMILESC[C@H]1CC=C(C(C)(C)O)CC1
InChIInChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h6,8,11H,4-5,7H2,1-3H3/t8-/m0/s1
InChIKeyHMXMWOXFKFLOGK-QMMMGPOBSA-N
XLogP2.50
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 ≤ 52.50
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 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol?
The IUPAC name of 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol (CID 11367124) is 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol.
What is the SMILES notation for 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol?
The canonical SMILES for 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol is C[C@H]1CC=C(C(C)(C)O)CC1.
What is the InChIKey of 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol?
The InChIKey is HMXMWOXFKFLOGK-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h6,8,11H,4-5,7H2,1-3H3/t8-/m0/s1.
What are the key properties of 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol?
2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol has a molecular weight of 154.25 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol is sourced from PubChem (CID 11367124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).