1-ethyl-2,6-dimethylnaphthalene

C14H16 — CID 20601360

IUPAC1-ethyl-2,6-dimethylnaphthalene
SMILESCCc1c(C)ccc2cc(C)ccc12
InChIInChI=1S/C14H16/c1-4-13-11(3)6-7-12-9-10(2)5-8-14(12)13/h5-9H,4H2,1-3H3
InChIKeyBOKKQBHJDWVHPP-UHFFFAOYSA-N
MW184.28 g/mol
LogP4.02
Rot. Bonds1

About 1-ethyl-2,6-dimethylnaphthalene

1-ethyl-2,6-dimethylnaphthalene (PubChem CID 20601360) has the molecular formula C14H16 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-ethyl-2,6-dimethylnaphthalene.

Molecular Properties

Compound Name1-ethyl-2,6-dimethylnaphthalene
PubChem CID20601360
Molecular FormulaC14H16
Molecular Weight184.28 g/mol
Exact Mass184.13
IUPAC Name1-ethyl-2,6-dimethylnaphthalene
SMILESCCc1c(C)ccc2cc(C)ccc12
InChIInChI=1S/C14H16/c1-4-13-11(3)6-7-12-9-10(2)5-8-14(12)13/h5-9H,4H2,1-3H3
InChIKeyBOKKQBHJDWVHPP-UHFFFAOYSA-N
XLogP4.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethyl-7-methylphenanthrene
CID 59758331
1-ethyl-2,7-dimethylpyrene
CID 151632045
2,7-dimethylphenanthrene;ethane
CID 91503011
2,9-dimethylnaphtho[1,2-b]phenanthrene;3,10-dimethylnaphtho[1,2-b]phenanthrene
CID 164992833
2,6-dimethylnaphthalene;propane
CID 142191183
1-fluoro-2,7-dimethylphenanthrene
CID 21032854
2,9-dimethylnaphtho[1,2-b]phenanthrene
CID 58426646
6-methyl-5-propylnaphthalen-2-ol
CID 144690902
1-ethynyl-2,6-dimethylnaphthalene
CID 142157789
ethane;1-ethyl-6-methylnaphthalene
CID 91003856
2-ethyl-6-methyl-1-[(Z)-prop-1-enyl]naphthalene
CID 144639812
8-ethyl-7-methylnaphthalene-2-carboxamide
CID 142518693

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,6-dimethylnaphthalene?
The IUPAC name of 1-ethyl-2,6-dimethylnaphthalene (CID 20601360) is 1-ethyl-2,6-dimethylnaphthalene.
What is the SMILES notation for 1-ethyl-2,6-dimethylnaphthalene?
The canonical SMILES for 1-ethyl-2,6-dimethylnaphthalene is CCc1c(C)ccc2cc(C)ccc12.
What is the InChIKey of 1-ethyl-2,6-dimethylnaphthalene?
The InChIKey is BOKKQBHJDWVHPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16/c1-4-13-11(3)6-7-12-9-10(2)5-8-14(12)13/h5-9H,4H2,1-3H3.
What are the key properties of 1-ethyl-2,6-dimethylnaphthalene?
1-ethyl-2,6-dimethylnaphthalene has a molecular weight of 184.28 g/mol, XLogP of 4.02, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,6-dimethylnaphthalene is sourced from PubChem (CID 20601360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).