[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol

C10H16O — CID 11788398

IUPAC[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol
SMILESC=C(C)[C@H]1CC=C(CO)CC1
InChIInChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3/t10-/m0/s1
InChIKeyNDTYTMIUWGWIMO-JTQLQIEISA-N
MW152.24 g/mol
LogP2.28
Rot. Bonds2

About [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol

[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol (PubChem CID 11788398) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol.

Molecular Properties

Compound Name[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol
PubChem CID11788398
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol
SMILESC=C(C)[C@H]1CC=C(CO)CC1
InChIInChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3/t10-/m0/s1
InChIKeyNDTYTMIUWGWIMO-JTQLQIEISA-N
XLogP2.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.28
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 [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol?
The IUPAC name of [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol (CID 11788398) is [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol.
What is the SMILES notation for [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol?
The canonical SMILES for [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol is C=C(C)[C@H]1CC=C(CO)CC1.
What is the InChIKey of [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol?
The InChIKey is NDTYTMIUWGWIMO-JTQLQIEISA-N. The full InChI is InChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3/t10-/m0/s1.
What are the key properties of [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol?
[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol has a molecular weight of 152.24 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methanol is sourced from PubChem (CID 11788398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).