4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene

C15H24 — CID 14890909

IUPAC4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene
SMILESCC(C)=C1CCC2=C(C1)C(C)(C)CCC2
InChIInChI=1S/C15H24/c1-11(2)13-8-7-12-6-5-9-15(3,4)14(12)10-13/h5-10H2,1-4H3
InChIKeyXXPZIEGTSYKKDA-UHFFFAOYSA-N
MW204.36 g/mol
LogP5.01
Rot. Bonds

About 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene

4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene (PubChem CID 14890909) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene.

Molecular Properties

Compound Name4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene
PubChem CID14890909
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene
SMILESCC(C)=C1CCC2=C(C1)C(C)(C)CCC2
InChIInChI=1S/C15H24/c1-11(2)13-8-7-12-6-5-9-15(3,4)14(12)10-13/h5-10H2,1-4H3
InChIKeyXXPZIEGTSYKKDA-UHFFFAOYSA-N
XLogP5.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500204.36
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4,4,8,8-tetramethyl-1,2,3,5,6,7-hexahydronaphthalene
CID 71441384
(2R,3R)-2,3,8,8-tetramethyl-2,3,4,5,6,7-hexahydro-1H-naphthalene
CID 143276982
4,4,7,7-tetramethyl-1,2,3,5,6,8-hexahydronaphthalene
CID 175928717
5,5-dimethyl-1,3,4,6,7,8-hexahydronaphthalen-2-one
CID 71497678
acetaldehyde;(2S,3S)-2,3,8,8-tetramethyl-2,3,4,5,6,7-hexahydro-1H-naphthalene
CID 143002875
3-cyclopropylidene-1-methyl-1-prop-1-en-2-ylcyclohexane
CID 102109236
(1R,4aR,8aR)-1,4a-dimethyl-7-propan-2-ylidene-3,4,5,6,8,8a-hexahydro-2H-naphthalen-1-ol
CID 139059301
(1S,4aR,8aR)-1,4a-dimethyl-7-propan-2-ylidene-3,4,5,6,8,8a-hexahydro-2H-naphthalen-1-ol
CID 22211695
6,6-dimethyl-3,4a,5,7,8,9,10,10a-octahydro-2H-benzo[g]phthalazine-1,4-dione
CID 563512
(4aS,8aR)-8a-methyl-4-methylidene-6-propan-2-ylidene-2,3,4a,5,7,8-hexahydro-1H-naphthalene
CID 10655819
7-ethenyl-4,4,7-trimethyl-1,2,3,5,6,8-hexahydronaphthalene
CID 10536210
2,4,4-trimethyl-3-[2-(2,7,7-trimethyl-3,4,5,6-tetrahydroinden-1-yl)ethyl]-1,5,6,7-tetrahydroindene
CID 18705425

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene?
The IUPAC name of 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene (CID 14890909) is 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene.
What is the SMILES notation for 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene?
The canonical SMILES for 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene is CC(C)=C1CCC2=C(C1)C(C)(C)CCC2.
What is the InChIKey of 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene?
The InChIKey is XXPZIEGTSYKKDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-11(2)13-8-7-12-6-5-9-15(3,4)14(12)10-13/h5-10H2,1-4H3.
What are the key properties of 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene?
4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene has a molecular weight of 204.36 g/mol, XLogP of 5.01, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-6-propan-2-ylidene-1,2,3,5,7,8-hexahydronaphthalene is sourced from PubChem (CID 14890909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).