4,4-diethyl-2,3-dihydro-1H-naphthalene

C14H20 — CID 520431

IUPAC4,4-diethyl-2,3-dihydro-1H-naphthalene
SMILESCCC1(CC)CCCc2ccccc21
InChIInChI=1S/C14H20/c1-3-14(4-2)11-7-9-12-8-5-6-10-13(12)14/h5-6,8,10H,3-4,7,9,11H2,1-2H3
InChIKeyDBFQMDNLSBZPMF-UHFFFAOYSA-N
MW188.31 g/mol
LogP4.08
Rot. Bonds2

About 4,4-diethyl-2,3-dihydro-1H-naphthalene

4,4-diethyl-2,3-dihydro-1H-naphthalene (PubChem CID 520431) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 4,4-diethyl-2,3-dihydro-1H-naphthalene.

Molecular Properties

Compound Name4,4-diethyl-2,3-dihydro-1H-naphthalene
PubChem CID520431
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name4,4-diethyl-2,3-dihydro-1H-naphthalene
SMILESCCC1(CC)CCCc2ccccc21
InChIInChI=1S/C14H20/c1-3-14(4-2)11-7-9-12-8-5-6-10-13(12)14/h5-6,8,10H,3-4,7,9,11H2,1-2H3
InChIKeyDBFQMDNLSBZPMF-UHFFFAOYSA-N
XLogP4.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 66059601
[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl-trimethylsilane
CID 106324106
[1-(2-methylbutyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 63521983
4-(bromomethyl)-4-heptyl-2,3-dihydro-1H-naphthalene
CID 66047892
4-(bromomethyl)-4-nonyl-2,3-dihydro-1H-naphthalene
CID 66047893
2-(1-ethyl-2,3-dihydroinden-1-yl)-N,N-dimethylethanamine
CID 142113085
4-(chloromethyl)-4-(2-propylsulfonylethyl)-2,3-dihydro-1H-naphthalene
CID 106734497
N-[[1-(2-methylbutyl)-3,4-dihydro-2H-naphthalen-1-yl]methyl]propan-2-amine
CID 63502125
1-[1-(methoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]-N-methylmethanamine
CID 103984610
4-(chloromethyl)-4-[(3,5-dimethylphenyl)methyl]-2,3-dihydro-1H-naphthalene
CID 66036331
[1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 66058133
ethane;2-[1-(methylaminomethyl)-3,4-dihydro-2H-naphthalen-1-yl]acetaldehyde
CID 163377790

Frequently Asked Questions

What is the IUPAC name of 4,4-diethyl-2,3-dihydro-1H-naphthalene?
The IUPAC name of 4,4-diethyl-2,3-dihydro-1H-naphthalene (CID 520431) is 4,4-diethyl-2,3-dihydro-1H-naphthalene.
What is the SMILES notation for 4,4-diethyl-2,3-dihydro-1H-naphthalene?
The canonical SMILES for 4,4-diethyl-2,3-dihydro-1H-naphthalene is CCC1(CC)CCCc2ccccc21.
What is the InChIKey of 4,4-diethyl-2,3-dihydro-1H-naphthalene?
The InChIKey is DBFQMDNLSBZPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20/c1-3-14(4-2)11-7-9-12-8-5-6-10-13(12)14/h5-6,8,10H,3-4,7,9,11H2,1-2H3.
What are the key properties of 4,4-diethyl-2,3-dihydro-1H-naphthalene?
4,4-diethyl-2,3-dihydro-1H-naphthalene has a molecular weight of 188.31 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diethyl-2,3-dihydro-1H-naphthalene is sourced from PubChem (CID 520431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).