3-methyl-4a,10-dihydroanthracene

C15H14 — CID 58426249

IUPAC3-methyl-4a,10-dihydroanthracene
SMILESCC1=CC2Cc3ccccc3C=C2C=C1
InChIInChI=1S/C15H14/c1-11-6-7-14-9-12-4-2-3-5-13(12)10-15(14)8-11/h2-9,15H,10H2,1H3
InChIKeyXOBIHSZYBNYUGX-UHFFFAOYSA-N
MW194.28 g/mol
LogP3.76
Rot. Bonds

About 3-methyl-4a,10-dihydroanthracene

3-methyl-4a,10-dihydroanthracene (PubChem CID 58426249) has the molecular formula C15H14 and a molecular weight of 194.28 g/mol. Its IUPAC name is 3-methyl-4a,10-dihydroanthracene.

Molecular Properties

Compound Name3-methyl-4a,10-dihydroanthracene
PubChem CID58426249
Molecular FormulaC15H14
Molecular Weight194.28 g/mol
Exact Mass194.11
IUPAC Name3-methyl-4a,10-dihydroanthracene
SMILESCC1=CC2Cc3ccccc3C=C2C=C1
InChIInChI=1S/C15H14/c1-11-6-7-14-9-12-4-2-3-5-13(12)10-15(14)8-11/h2-9,15H,10H2,1H3
InChIKeyXOBIHSZYBNYUGX-UHFFFAOYSA-N
XLogP3.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3-methyl-4a,10-dihydroanthracene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3-dimethyl-1,2-dihydronaphthalene
CID 121008714
(13Z)-3,6-dimethyl-4a,5,7,12-tetrahydrobenzo[d][2]benzazonine
CID 10354804
ethane;2-methyl-1H-indene
CID 54388135
(9aR)-2,2-dimethyl-1,3,9,9a-tetrahydrobenzo[f]isoindol-2-ium
CID 1427198
dilithium;hydride;2-methyl-1H-indene
CID 174389256
2-methyl-1H-indene;titanium(3+);trichloride
CID 157408587
2-(1,2-dihydronaphthalen-2-yl)-1,2-dihydronaphthalene
CID 71322997
ethane;(2Z)-10-methyltricyclo[10.4.0.04,9]hexadeca-1(16),2,4,6,8,12,14-heptaene
CID 156719082
6,7-dimethyl-9H-benzo[7]annulene
CID 142104722
(2R)-1,2-dihydronaphthalen-2-ol
CID 12963098
1-fluoro-3-methyl-5-phenylcyclohexa-1,3-diene
CID 163813162
2-[(4-tert-butylcyclohex-2-en-1-yl)methyl]-3-methyl-1,2-dihydronaphthalene
CID 143617235

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4a,10-dihydroanthracene?
The IUPAC name of 3-methyl-4a,10-dihydroanthracene (CID 58426249) is 3-methyl-4a,10-dihydroanthracene.
What is the SMILES notation for 3-methyl-4a,10-dihydroanthracene?
The canonical SMILES for 3-methyl-4a,10-dihydroanthracene is CC1=CC2Cc3ccccc3C=C2C=C1.
What is the InChIKey of 3-methyl-4a,10-dihydroanthracene?
The InChIKey is XOBIHSZYBNYUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14/c1-11-6-7-14-9-12-4-2-3-5-13(12)10-15(14)8-11/h2-9,15H,10H2,1H3.
What are the key properties of 3-methyl-4a,10-dihydroanthracene?
3-methyl-4a,10-dihydroanthracene has a molecular weight of 194.28 g/mol, XLogP of 3.76, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4a,10-dihydroanthracene is sourced from PubChem (CID 58426249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).