1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene

C12H14 — CID 13067250

IUPAC1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene
SMILESC=C1CCC(C)c2ccccc21
InChIInChI=1S/C12H14/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-6,10H,1,7-8H2,2H3
InChIKeyWTPNOCYHOZTSNK-UHFFFAOYSA-N
MW158.24 g/mol
LogP3.60
Rot. Bonds

About 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene

1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene (PubChem CID 13067250) has the molecular formula C12H14 and a molecular weight of 158.24 g/mol. Its IUPAC name is 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene.

Molecular Properties

Compound Name1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene
PubChem CID13067250
Molecular FormulaC12H14
Molecular Weight158.24 g/mol
Exact Mass158.11
IUPAC Name1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene
SMILESC=C1CCC(C)c2ccccc21
InChIInChI=1S/C12H14/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-6,10H,1,7-8H2,2H3
InChIKeyWTPNOCYHOZTSNK-UHFFFAOYSA-N
XLogP3.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene?
The IUPAC name of 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene (CID 13067250) is 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene.
What is the SMILES notation for 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene?
The canonical SMILES for 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene is C=C1CCC(C)c2ccccc21.
What is the InChIKey of 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene?
The InChIKey is WTPNOCYHOZTSNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-6,10H,1,7-8H2,2H3.
What are the key properties of 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene?
1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene has a molecular weight of 158.24 g/mol, XLogP of 3.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-methylidene-2,3-dihydro-1H-naphthalene is sourced from PubChem (CID 13067250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).