(1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol

C15H24O — CID 15109138

IUPAC(1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol
SMILESC=C1[C@H](O)C[C@H](C(C)C)[C@@]12CC=C(C)CC2
InChIInChI=1S/C15H24O/c1-10(2)13-9-14(16)12(4)15(13)7-5-11(3)6-8-15/h5,10,13-14,16H,4,6-9H2,1-3H3/t13-,14-,15-/m1/s1
InChIKeyNROQFHKUAQVZGM-RBSFLKMASA-N
MW220.36 g/mol
LogP3.70
Rot. Bonds1

About (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol

(1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol (PubChem CID 15109138) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol.

Molecular Properties

Compound Name(1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol
PubChem CID15109138
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name(1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol
SMILESC=C1[C@H](O)C[C@H](C(C)C)[C@@]12CC=C(C)CC2
InChIInChI=1S/C15H24O/c1-10(2)13-9-14(16)12(4)15(13)7-5-11(3)6-8-15/h5,10,13-14,16H,4,6-9H2,1-3H3/t13-,14-,15-/m1/s1
InChIKeyNROQFHKUAQVZGM-RBSFLKMASA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
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 (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol?
The IUPAC name of (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol (CID 15109138) is (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol.
What is the SMILES notation for (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol?
The canonical SMILES for (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol is C=C1[C@H](O)C[C@H](C(C)C)[C@@]12CC=C(C)CC2.
What is the InChIKey of (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol?
The InChIKey is NROQFHKUAQVZGM-RBSFLKMASA-N. The full InChI is InChI=1S/C15H24O/c1-10(2)13-9-14(16)12(4)15(13)7-5-11(3)6-8-15/h5,10,13-14,16H,4,6-9H2,1-3H3/t13-,14-,15-/m1/s1.
What are the key properties of (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol?
(1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol has a molecular weight of 220.36 g/mol, XLogP of 3.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3R,5R)-8-methyl-4-methylidene-1-propan-2-ylspiro[4.5]dec-8-en-3-ol is sourced from PubChem (CID 15109138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).