(1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol

C15H24O — CID 91714964

IUPAC(1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol
SMILESC=C(C)C1CCC(C)C12CC=C(CO)CC2
InChIInChI=1S/C15H24O/c1-11(2)14-5-4-12(3)15(14)8-6-13(10-16)7-9-15/h6,12,14,16H,1,4-5,7-10H2,2-3H3
InChIKeyKBMDEJULGPFFGC-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.70
Rot. Bonds2

About (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol

(1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol (PubChem CID 91714964) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol.

Molecular Properties

Compound Name(1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol
PubChem CID91714964
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name(1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol
SMILESC=C(C)C1CCC(C)C12CC=C(CO)CC2
InChIInChI=1S/C15H24O/c1-11(2)14-5-4-12(3)15(14)8-6-13(10-16)7-9-15/h6,12,14,16H,1,4-5,7-10H2,2-3H3
InChIKeyKBMDEJULGPFFGC-UHFFFAOYSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.70
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 (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol?
The IUPAC name of (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol (CID 91714964) is (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol.
What is the SMILES notation for (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol?
The canonical SMILES for (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol is C=C(C)C1CCC(C)C12CC=C(CO)CC2.
What is the InChIKey of (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol?
The InChIKey is KBMDEJULGPFFGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-11(2)14-5-4-12(3)15(14)8-6-13(10-16)7-9-15/h6,12,14,16H,1,4-5,7-10H2,2-3H3.
What are the key properties of (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol?
(1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol has a molecular weight of 220.36 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-4-prop-1-en-2-ylspiro[4.5]dec-8-en-8-yl)methanol is sourced from PubChem (CID 91714964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).