ethane;1-ethyl-7-methylnaphthalene

C15H20 — CID 91014752

IUPACethane;1-ethyl-7-methylnaphthalene
SMILESCC.CCc1cccc2ccc(C)cc12
InChIInChI=1S/C13H14.C2H6/c1-3-11-5-4-6-12-8-7-10(2)9-13(11)12;1-2/h4-9H,3H2,1-2H3;1-2H3
InChIKeyFLZCIXIOWQWWNP-UHFFFAOYSA-N
MW200.32 g/mol
LogP4.74
Rot. Bonds1

About ethane;1-ethyl-7-methylnaphthalene

ethane;1-ethyl-7-methylnaphthalene (PubChem CID 91014752) has the molecular formula C15H20 and a molecular weight of 200.32 g/mol. Its IUPAC name is ethane;1-ethyl-7-methylnaphthalene.

Molecular Properties

Compound Nameethane;1-ethyl-7-methylnaphthalene
PubChem CID91014752
Molecular FormulaC15H20
Molecular Weight200.32 g/mol
Exact Mass200.16
IUPAC Nameethane;1-ethyl-7-methylnaphthalene
SMILESCC.CCc1cccc2ccc(C)cc12
InChIInChI=1S/C13H14.C2H6/c1-3-11-5-4-6-12-8-7-10(2)9-13(11)12;1-2/h4-9H,3H2,1-2H3;1-2H3
InChIKeyFLZCIXIOWQWWNP-UHFFFAOYSA-N
XLogP4.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethyl-7-methylnaphthalene
CID 12778771
ethane;1-ethyl-6-methylnaphthalene
CID 91003856
1-ethyl-7-fluoronaphthalene
CID 166534047
ethane;1-ethenyl-2-ethyl-7-methylnaphthalene
CID 142614708
azane;1-hexyl-7-methylnaphthalene
CID 174691158
8-ethylnaphthalene-2-carboxylic acid
CID 151555828
azane;1-ethylnaphthalene
CID 19048185
1-ethylnaphthalene;pyrene
CID 174849884
7-methylnaphthalene-1-carbaldehyde
CID 15657410
ethane;7-methyl-1-propan-2-ylnaphthalene
CID 177009970
sodium 7-methylnaphthalene-1-sulfonate
CID 101315116
sodium;1-ethylnaphthalene;hydride
CID 174300793

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-7-methylnaphthalene?
The IUPAC name of ethane;1-ethyl-7-methylnaphthalene (CID 91014752) is ethane;1-ethyl-7-methylnaphthalene.
What is the SMILES notation for ethane;1-ethyl-7-methylnaphthalene?
The canonical SMILES for ethane;1-ethyl-7-methylnaphthalene is CC.CCc1cccc2ccc(C)cc12.
What is the InChIKey of ethane;1-ethyl-7-methylnaphthalene?
The InChIKey is FLZCIXIOWQWWNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14.C2H6/c1-3-11-5-4-6-12-8-7-10(2)9-13(11)12;1-2/h4-9H,3H2,1-2H3;1-2H3.
What are the key properties of ethane;1-ethyl-7-methylnaphthalene?
ethane;1-ethyl-7-methylnaphthalene has a molecular weight of 200.32 g/mol, XLogP of 4.74, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-7-methylnaphthalene is sourced from PubChem (CID 91014752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).