8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol

C15H24O — CID 162850366

IUPAC8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol
SMILESC=C(C)C1(O)CCC2=CCCC(C)C2(C)C1
InChIInChI=1S/C15H24O/c1-11(2)15(16)9-8-13-7-5-6-12(3)14(13,4)10-15/h7,12,16H,1,5-6,8-10H2,2-4H3
InChIKeyGXJHWPXQNVJRCC-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.84
Rot. Bonds1

About 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol

8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol (PubChem CID 162850366) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol.

Molecular Properties

Compound Name8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol
PubChem CID162850366
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol
SMILESC=C(C)C1(O)CCC2=CCCC(C)C2(C)C1
InChIInChI=1S/C15H24O/c1-11(2)15(16)9-8-13-7-5-6-12(3)14(13,4)10-15/h7,12,16H,1,5-6,8-10H2,2-4H3
InChIKeyGXJHWPXQNVJRCC-UHFFFAOYSA-N
XLogP3.84
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 ≤ 53.84
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 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol?
The IUPAC name of 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol (CID 162850366) is 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol.
What is the SMILES notation for 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol?
The canonical SMILES for 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol is C=C(C)C1(O)CCC2=CCCC(C)C2(C)C1.
What is the InChIKey of 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol?
The InChIKey is GXJHWPXQNVJRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-11(2)15(16)9-8-13-7-5-6-12(3)14(13,4)10-15/h7,12,16H,1,5-6,8-10H2,2-4H3.
What are the key properties of 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol?
8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol has a molecular weight of 220.36 g/mol, XLogP of 3.84, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8a-dimethyl-2-prop-1-en-2-yl-1,3,4,6,7,8-hexahydronaphthalen-2-ol is sourced from PubChem (CID 162850366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).