(3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene

C13H18 — CID 163672179

IUPAC(3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene
SMILESCCC1Cc2ccccc2C[C@H]1C
InChIInChI=1S/C13H18/c1-3-11-9-13-7-5-4-6-12(13)8-10(11)2/h4-7,10-11H,3,8-9H2,1-2H3/t10-,11?/m1/s1
InChIKeyJDMZFQHMHRNMGV-NFJWQWPMSA-N
MW174.29 g/mol
LogP3.45
Rot. Bonds1

About (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene

(3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene (PubChem CID 163672179) has the molecular formula C13H18 and a molecular weight of 174.29 g/mol. Its IUPAC name is (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name(3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene
PubChem CID163672179
Molecular FormulaC13H18
Molecular Weight174.29 g/mol
Exact Mass174.14
IUPAC Name(3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene
SMILESCCC1Cc2ccccc2C[C@H]1C
InChIInChI=1S/C13H18/c1-3-11-9-13-7-5-4-6-12(13)8-10(11)2/h4-7,10-11H,3,8-9H2,1-2H3/t10-,11?/m1/s1
InChIKeyJDMZFQHMHRNMGV-NFJWQWPMSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene 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

3-ethyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 89150261
(2R,3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydroquinoline
CID 15312191
(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 130469930
2-ethyl-3-(2-methylbutan-2-yl)-1,2,3,4-tetrahydronaphthalene;propan-2-amine
CID 142059776
3,17-diethyl-2,18-dimethylpentacyclo[9.7.1.11,5.015,19.09,20]icosa-5,7,9(20),11(19),12,14-hexaene
CID 161199772
methane;2-methyl-2,3-dihydro-1H-indene
CID 142040721
3-benzyl-4-ethyl-2,3,4,5-tetrahydro-1H-2-benzazepine
CID 79007517
(2R,3S)-3-ethyl-2-phenyl-1,2,3,4-tetrahydroquinoline
CID 70994764
(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine
CID 134490907
(2R)-1-ethoxy-2-methyl-2,3-dihydro-1H-indene
CID 59880475
(3R)-3-ethyl-3,4-dihydro-1H-isochromene
CID 130319265
(7S)-6,7-diethyl-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 89333129

Frequently Asked Questions

What is the IUPAC name of (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene (CID 163672179) is (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene is CCC1Cc2ccccc2C[C@H]1C.
What is the InChIKey of (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is JDMZFQHMHRNMGV-NFJWQWPMSA-N. The full InChI is InChI=1S/C13H18/c1-3-11-9-13-7-5-4-6-12(13)8-10(11)2/h4-7,10-11H,3,8-9H2,1-2H3/t10-,11?/m1/s1.
What are the key properties of (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene?
(3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 174.29 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 163672179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).