2-(6-chloronaphthalen-2-yl)oxyethanamine

C12H12ClNO — CID 84687251

IUPAC2-(6-chloronaphthalen-2-yl)oxyethanamine
SMILESNCCOc1ccc2cc(Cl)ccc2c1
InChIInChI=1S/C12H12ClNO/c13-11-3-1-10-8-12(15-6-5-14)4-2-9(10)7-11/h1-4,7-8H,5-6,14H2
InChIKeyGBEBZJQLJNUAII-UHFFFAOYSA-N
MW221.69 g/mol
LogP2.83
Rot. Bonds3

About 2-(6-chloronaphthalen-2-yl)oxyethanamine

2-(6-chloronaphthalen-2-yl)oxyethanamine (PubChem CID 84687251) has the molecular formula C12H12ClNO and a molecular weight of 221.69 g/mol. Its IUPAC name is 2-(6-chloronaphthalen-2-yl)oxyethanamine.

Molecular Properties

Compound Name2-(6-chloronaphthalen-2-yl)oxyethanamine
PubChem CID84687251
Molecular FormulaC12H12ClNO
Molecular Weight221.69 g/mol
Exact Mass221.06
IUPAC Name2-(6-chloronaphthalen-2-yl)oxyethanamine
SMILESNCCOc1ccc2cc(Cl)ccc2c1
InChIInChI=1S/C12H12ClNO/c13-11-3-1-10-8-12(15-6-5-14)4-2-9(10)7-11/h1-4,7-8H,5-6,14H2
InChIKeyGBEBZJQLJNUAII-UHFFFAOYSA-N
XLogP2.83
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.69
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-6-propoxynaphthalene
CID 125116367
CID 58656003
CID 58656003
2-(6-propan-2-ylnaphthalen-2-yl)oxyethanamine
CID 123913682
[5-chloro-2-(2-naphthalen-2-yloxyethoxy)phenyl]methanamine
CID 22687111
2-[6-(2-aminoethoxy)acridin-3-yl]oxyethanamine;hydrochloride
CID 88770124
2-[4-(3-chlorophenoxy)phenoxy]ethanamine
CID 19881384
2-[4-(2-aminoethoxy)phenoxy]ethanamine;dihydrochloride
CID 46786149
2-[(2-chloro-4-pyridinyl)oxy]ethanamine
CID 84654514
2-chloro-6-phenylmethoxynaphthalene
CID 125116795
2-[6-(2-aminoethoxy)acridin-3-yl]oxyethanamine;hydrate;hydrochloride
CID 45260071
2-(1H-indol-5-yloxy)ethanamine
CID 84655544
2-(7-chloronaphthalen-2-yl)oxyacetic acid
CID 154365176

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloronaphthalen-2-yl)oxyethanamine?
The IUPAC name of 2-(6-chloronaphthalen-2-yl)oxyethanamine (CID 84687251) is 2-(6-chloronaphthalen-2-yl)oxyethanamine.
What is the SMILES notation for 2-(6-chloronaphthalen-2-yl)oxyethanamine?
The canonical SMILES for 2-(6-chloronaphthalen-2-yl)oxyethanamine is NCCOc1ccc2cc(Cl)ccc2c1.
What is the InChIKey of 2-(6-chloronaphthalen-2-yl)oxyethanamine?
The InChIKey is GBEBZJQLJNUAII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClNO/c13-11-3-1-10-8-12(15-6-5-14)4-2-9(10)7-11/h1-4,7-8H,5-6,14H2.
What are the key properties of 2-(6-chloronaphthalen-2-yl)oxyethanamine?
2-(6-chloronaphthalen-2-yl)oxyethanamine has a molecular weight of 221.69 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloronaphthalen-2-yl)oxyethanamine is sourced from PubChem (CID 84687251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).