2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene

C14H16 — CID 10511708

IUPAC2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene
SMILESC=CCC1=C(C)Cc2ccccc2C1
InChIInChI=1S/C14H16/c1-3-6-12-10-14-8-5-4-7-13(14)9-11(12)2/h3-5,7-8H,1,6,9-10H2,2H3
InChIKeyRIDZBMJHKNVPGG-UHFFFAOYSA-N
MW184.28 g/mol
LogP3.68
Rot. Bonds2

About 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene

2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene (PubChem CID 10511708) has the molecular formula C14H16 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene.

Molecular Properties

Compound Name2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene
PubChem CID10511708
Molecular FormulaC14H16
Molecular Weight184.28 g/mol
Exact Mass184.13
IUPAC Name2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene
SMILESC=CCC1=C(C)Cc2ccccc2C1
InChIInChI=1S/C14H16/c1-3-6-12-10-14-8-5-4-7-13(14)9-11(12)2/h3-5,7-8H,1,6,9-10H2,2H3
InChIKeyRIDZBMJHKNVPGG-UHFFFAOYSA-N
XLogP3.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 53.68
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

1-methyl-2-prop-2-enylbenzene;sulfane
CID 174918280
methane;1-methyl-2-prop-2-enylbenzene
CID 174365033
butane;2,3-dimethyl-1,4-dihydronaphthalene;propan-1-imine
CID 91511684
2-methylprop-1-ene;prop-2-enylbenzene
CID 142174904
2,3-bis(ethenyl)-1,4-dihydronaphthalene;methane
CID 142529129
9,10-dihydroanthracene;methanamine
CID 123513741
butan-2-imine;butan-2-ol;2,3-dimethyl-1,4-dihydronaphthalene
CID 91573857
ethane;2-methylidene-1,3-dihydroindene
CID 90790754
prop-2-enylbenzene
CID 159998516
bicyclo[4.1.0]hepta-1,3,5-triene;toluene
CID 173262949
ethyl 3-hydroxy-1-methyl-4-prop-2-enyl-9,10-dihydroanthracene-2-carboxylate
CID 101381862
3-[(Z)-but-2-en-2-yl]-2-methyl-1H-indene
CID 142104556

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene?
The IUPAC name of 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene (CID 10511708) is 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene.
What is the SMILES notation for 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene?
The canonical SMILES for 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene is C=CCC1=C(C)Cc2ccccc2C1.
What is the InChIKey of 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene?
The InChIKey is RIDZBMJHKNVPGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16/c1-3-6-12-10-14-8-5-4-7-13(14)9-11(12)2/h3-5,7-8H,1,6,9-10H2,2H3.
What are the key properties of 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene?
2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene has a molecular weight of 184.28 g/mol, XLogP of 3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-prop-2-enyl-1,4-dihydronaphthalene is sourced from PubChem (CID 10511708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).