3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene

C16H16 — CID 141344332

IUPAC3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene
SMILESCCC1=CC(C)c2c1ccc1ccccc21
InChIInChI=1S/C16H16/c1-3-12-10-11(2)16-14-7-5-4-6-13(14)8-9-15(12)16/h4-11H,3H2,1-2H3
InChIKeyIJSQRQAIPONMFT-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.75
Rot. Bonds1

About 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene

3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene (PubChem CID 141344332) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene.

Molecular Properties

Compound Name3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene
PubChem CID141344332
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene
SMILESCCC1=CC(C)c2c1ccc1ccccc21
InChIInChI=1S/C16H16/c1-3-12-10-11(2)16-14-7-5-4-6-13(14)8-9-15(12)16/h4-11H,3H2,1-2H3
InChIKeyIJSQRQAIPONMFT-UHFFFAOYSA-N
XLogP4.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene 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

1-methyl-2-(2,3,5-trimethylcyclopenta-1,3-dien-1-yl)naphthalene
CID 23015278
12-naphthalen-1-ylpentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 633780
1-chloro-1H-cyclopropa[a]naphthalene
CID 67741182
1,2,2,4-tetramethyl-1H-benzo[f]isoquinoline
CID 3130838
(1S)-1,2,2,4-tetramethyl-1H-benzo[f]isoquinoline
CID 1203686
nonacyclo[30.8.0.02,11.03,8.012,21.015,20.022,31.023,28.035,40]tetraconta-1(32),2(11),3,5,7,9,12(21),13,15,17,19,22(31),23,25,27,29,33,35,37,39-icosaene
CID 15525083
2-methyl-2H-phenanthren-1-one
CID 154182792
ethane;methane;phenanthrene
CID 144938954
ethane;methane;phenanthrene
CID 144939263
7-ethyl-9-methyl-9,10-dihydrobenzo[h]quinoline;propane
CID 170732956
bis(3-chloro-2-ethyl-1H-cyclopenta[a]naphthalen-1-yl)-methyl-phenylsilane
CID 141006637
1H-cyclopenta[a]naphthalene-1,2,3-triol
CID 86632047

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene?
The IUPAC name of 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene (CID 141344332) is 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene.
What is the SMILES notation for 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene?
The canonical SMILES for 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene is CCC1=CC(C)c2c1ccc1ccccc21.
What is the InChIKey of 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene?
The InChIKey is IJSQRQAIPONMFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-3-12-10-11(2)16-14-7-5-4-6-13(14)8-9-15(12)16/h4-11H,3H2,1-2H3.
What are the key properties of 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene?
3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene has a molecular weight of 208.30 g/mol, XLogP of 4.75, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methyl-1H-cyclopenta[a]naphthalene is sourced from PubChem (CID 141344332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).