1-(2-propylsulfonylethoxy)naphthalene

C15H18O3S — CID 106732634

IUPAC1-(2-propylsulfonylethoxy)naphthalene
SMILESCCCS(=O)(=O)CCOc1cccc2ccccc12
InChIInChI=1S/C15H18O3S/c1-2-11-19(16,17)12-10-18-15-9-5-7-13-6-3-4-8-14(13)15/h3-9H,2,10-12H2,1H3
InChIKeyOBOJLQDKAXPYBB-UHFFFAOYSA-N
MW278.37 g/mol
LogP3.04
Rot. Bonds6

About 1-(2-propylsulfonylethoxy)naphthalene

1-(2-propylsulfonylethoxy)naphthalene (PubChem CID 106732634) has the molecular formula C15H18O3S and a molecular weight of 278.37 g/mol. Its IUPAC name is 1-(2-propylsulfonylethoxy)naphthalene.

Molecular Properties

Compound Name1-(2-propylsulfonylethoxy)naphthalene
PubChem CID106732634
Molecular FormulaC15H18O3S
Molecular Weight278.37 g/mol
Exact Mass278.10
IUPAC Name1-(2-propylsulfonylethoxy)naphthalene
SMILESCCCS(=O)(=O)CCOc1cccc2ccccc12
InChIInChI=1S/C15H18O3S/c1-2-11-19(16,17)12-10-18-15-9-5-7-13-6-3-4-8-14(13)15/h3-9H,2,10-12H2,1H3
InChIKeyOBOJLQDKAXPYBB-UHFFFAOYSA-N
XLogP3.04
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-propylsulfonylethoxy)phenol
CID 106726690
1-ethyl-2-(2-propylsulfonylethoxy)benzene
CID 106732626
1-butoxynaphthalene
CID 13262700
1-propan-2-yl-2-(2-propylsulfonylethoxy)benzene
CID 106732629
2-bromo-3-(2-propylsulfonylethoxy)aniline
CID 106721733
1-[2-(2-propylsulfonylethoxy)phenyl]propan-1-amine
CID 106721929
lithium;1-ethoxynaphthalene;hydride
CID 174613942
3-methoxy-2-(2-propylsulfonylethoxy)benzoic acid
CID 106721769
1-butoxynaphthalene;pentane-1,5-diol
CID 67747662
1-butoxynaphthalene;thiophene;trifluoromethanesulfonic acid
CID 174980094
N-butyl-4-naphthalen-1-yloxybutan-1-amine
CID 2249724
1-(3-chloropropoxy)naphthalene
CID 12685615

Frequently Asked Questions

What is the IUPAC name of 1-(2-propylsulfonylethoxy)naphthalene?
The IUPAC name of 1-(2-propylsulfonylethoxy)naphthalene (CID 106732634) is 1-(2-propylsulfonylethoxy)naphthalene.
What is the SMILES notation for 1-(2-propylsulfonylethoxy)naphthalene?
The canonical SMILES for 1-(2-propylsulfonylethoxy)naphthalene is CCCS(=O)(=O)CCOc1cccc2ccccc12.
What is the InChIKey of 1-(2-propylsulfonylethoxy)naphthalene?
The InChIKey is OBOJLQDKAXPYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O3S/c1-2-11-19(16,17)12-10-18-15-9-5-7-13-6-3-4-8-14(13)15/h3-9H,2,10-12H2,1H3.
What are the key properties of 1-(2-propylsulfonylethoxy)naphthalene?
1-(2-propylsulfonylethoxy)naphthalene has a molecular weight of 278.37 g/mol, XLogP of 3.04, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propylsulfonylethoxy)naphthalene is sourced from PubChem (CID 106732634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).