1-(6-ethylnaphthalen-2-yl)ethanone

C14H14O — CID 23046884

IUPAC1-(6-ethylnaphthalen-2-yl)ethanone
SMILESCCc1ccc2cc(C(C)=O)ccc2c1
InChIInChI=1S/C14H14O/c1-3-11-4-5-14-9-12(10(2)15)6-7-13(14)8-11/h4-9H,3H2,1-2H3
InChIKeyJRTVLKHKSSSYJA-UHFFFAOYSA-N
MW198.26 g/mol
LogP3.60
Rot. Bonds2

About 1-(6-ethylnaphthalen-2-yl)ethanone

1-(6-ethylnaphthalen-2-yl)ethanone (PubChem CID 23046884) has the molecular formula C14H14O and a molecular weight of 198.26 g/mol. Its IUPAC name is 1-(6-ethylnaphthalen-2-yl)ethanone.

Molecular Properties

Compound Name1-(6-ethylnaphthalen-2-yl)ethanone
PubChem CID23046884
Molecular FormulaC14H14O
Molecular Weight198.26 g/mol
Exact Mass198.10
IUPAC Name1-(6-ethylnaphthalen-2-yl)ethanone
SMILESCCc1ccc2cc(C(C)=O)ccc2c1
InChIInChI=1S/C14H14O/c1-3-11-4-5-14-9-12(10(2)15)6-7-13(14)8-11/h4-9H,3H2,1-2H3
InChIKeyJRTVLKHKSSSYJA-UHFFFAOYSA-N
XLogP3.60
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-4-methoxybenzene;1-(6-ethylnaphthalen-2-yl)ethanone;methane;methoxymethane
CID 158794651
1-(7-acetylanthracen-2-yl)ethanone
CID 139364083
2-(6-acetylnaphthalen-2-yl)acetonitrile
CID 13404143
6-ethyl-N,N-dipropylnaphthalene-2-carboxamide
CID 153338338
1-(4-ethylphenyl)ethanone;formaldehyde
CID 143666715
1-(7-chloro-6-ethylnaphthalen-2-yl)ethanone
CID 123412123
1-(6-ethylsulfanylnaphthalen-2-yl)ethanone
CID 22152811
2-O-[2-(6-acetylnaphthalene-2-carbonyl)oxyethyl] 6-O-ethyl naphthalene-2,6-dicarboxylate
CID 67965026
1-[4-[4-(4-ethylphenyl)phenyl]phenyl]ethanone
CID 24807530
hexyl 2-(6-acetylnaphthalen-2-yl)acetate
CID 21412609
3-(6-ethylnaphthalen-2-yl)propanoic acid
CID 144687708
1-(6-ethylnaphthalen-2-yl)propan-1-imine
CID 137447304

Frequently Asked Questions

What is the IUPAC name of 1-(6-ethylnaphthalen-2-yl)ethanone?
The IUPAC name of 1-(6-ethylnaphthalen-2-yl)ethanone (CID 23046884) is 1-(6-ethylnaphthalen-2-yl)ethanone.
What is the SMILES notation for 1-(6-ethylnaphthalen-2-yl)ethanone?
The canonical SMILES for 1-(6-ethylnaphthalen-2-yl)ethanone is CCc1ccc2cc(C(C)=O)ccc2c1.
What is the InChIKey of 1-(6-ethylnaphthalen-2-yl)ethanone?
The InChIKey is JRTVLKHKSSSYJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O/c1-3-11-4-5-14-9-12(10(2)15)6-7-13(14)8-11/h4-9H,3H2,1-2H3.
What are the key properties of 1-(6-ethylnaphthalen-2-yl)ethanone?
1-(6-ethylnaphthalen-2-yl)ethanone has a molecular weight of 198.26 g/mol, XLogP of 3.60, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethylnaphthalen-2-yl)ethanone is sourced from PubChem (CID 23046884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).