1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone

C14H15NO2 — CID 71475376

IUPAC1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone
SMILESCC(=O)c1ccc2cc(NCCO)ccc2c1
InChIInChI=1S/C14H15NO2/c1-10(17)11-2-3-13-9-14(15-6-7-16)5-4-12(13)8-11/h2-5,8-9,15-16H,6-7H2,1H3
InChIKeyPTHLSJPESHLDKH-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.45
Rot. Bonds4

About 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone

1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone (PubChem CID 71475376) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone.

Molecular Properties

Compound Name1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone
PubChem CID71475376
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone
SMILESCC(=O)c1ccc2cc(NCCO)ccc2c1
InChIInChI=1S/C14H15NO2/c1-10(17)11-2-3-13-9-14(15-6-7-16)5-4-12(13)8-11/h2-5,8-9,15-16H,6-7H2,1H3
InChIKeyPTHLSJPESHLDKH-UHFFFAOYSA-N
XLogP2.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7-acetylanthracen-2-yl)ethanone
CID 139364083
1-[2-amino-4-(2-hydroxyethylamino)phenyl]ethanone
CID 104528257
2-[(E)-3-[6-(2-hydroxyethylamino)naphthalen-2-yl]-3-oxoprop-1-enyl]-3-methylbenzaldehyde
CID 122548409
1-[6-(cyclohexylamino)naphthalen-2-yl]ethanone
CID 121245244
1-[4-(propylamino)phenyl]ethanone
CID 7304598
1-(6-tert-butylnaphthalen-2-yl)ethanone
CID 59199741
1,4-bis[4-(2-hydroxyethylamino)phenyl]butane-1,4-dione
CID 70882599
1-(6-ethylnaphthalen-2-yl)ethanone
CID 23046884
N-[4-[(6-acetylnaphthalen-2-yl)amino]cyclohexyl]acetamide
CID 118980727
N-[2-(4-acetylanilino)ethyl]acetamide
CID 115573849
1-[4-chloro-3-(3-hydroxypropylamino)phenyl]ethanone
CID 82535645
4-[(6-methoxynaphthalen-2-yl)amino]butan-2-one
CID 115235467

Frequently Asked Questions

What is the IUPAC name of 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone?
The IUPAC name of 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone (CID 71475376) is 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone.
What is the SMILES notation for 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone?
The canonical SMILES for 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone is CC(=O)c1ccc2cc(NCCO)ccc2c1.
What is the InChIKey of 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone?
The InChIKey is PTHLSJPESHLDKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-10(17)11-2-3-13-9-14(15-6-7-16)5-4-12(13)8-11/h2-5,8-9,15-16H,6-7H2,1H3.
What are the key properties of 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone?
1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone has a molecular weight of 229.28 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone is sourced from PubChem (CID 71475376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).