2-[1-(ethoxyamino)ethyl]naphthalen-1-ol

C14H17NO2 — CID 82709739

IUPAC2-[1-(ethoxyamino)ethyl]naphthalen-1-ol
SMILESCCONC(C)c1ccc2ccccc2c1O
InChIInChI=1S/C14H17NO2/c1-3-17-15-10(2)12-9-8-11-6-4-5-7-13(11)14(12)16/h4-10,15-16H,3H2,1-2H3
InChIKeyBAWPYZWYZVSJJX-UHFFFAOYSA-N
MW231.29 g/mol
LogP3.15
Rot. Bonds4

About 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol

2-[1-(ethoxyamino)ethyl]naphthalen-1-ol (PubChem CID 82709739) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol.

Molecular Properties

Compound Name2-[1-(ethoxyamino)ethyl]naphthalen-1-ol
PubChem CID82709739
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name2-[1-(ethoxyamino)ethyl]naphthalen-1-ol
SMILESCCONC(C)c1ccc2ccccc2c1O
InChIInChI=1S/C14H17NO2/c1-3-17-15-10(2)12-9-8-11-6-4-5-7-13(11)14(12)16/h4-10,15-16H,3H2,1-2H3
InChIKeyBAWPYZWYZVSJJX-UHFFFAOYSA-N
XLogP3.15
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[1-(1-hydroxybutan-2-ylamino)ethyl]naphthalen-1-ol
CID 43207098
2-[1-(1-hydroxynaphthalen-2-yl)ethylamino]acetic acid
CID 43135176
2-[1-[(2,5-dimethylpyrrol-1-yl)amino]ethyl]naphthalen-1-ol
CID 79090793
2-[1-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl]naphthalen-1-ol
CID 81389862
2-(1-bromoethyl)naphthalen-1-ol
CID 140980182
2-[1-[2-(dimethylamino)ethylamino]ethyl]naphthalen-1-ol
CID 16787222
2-[1-[(2,2,3,3-tetramethylcyclopropyl)amino]ethyl]naphthalen-1-ol
CID 79353109
2-[1-[(2-methyl-3-methylsulfanylpropyl)amino]ethyl]naphthalen-1-ol
CID 63981736
2-[(1R)-2-methyl-1-[[(1R)-1-phenylethyl]amino]propyl]naphthalen-1-ol
CID 131854781
methyl 2-[1-(1-hydroxynaphthalen-2-yl)ethylamino]-2-methylpropanoate
CID 43726068
2-[1-[(3-methoxycyclopentyl)amino]ethyl]naphthalen-1-ol
CID 103083012
2-[1-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]ethyl]naphthalen-1-ol
CID 114750513

Frequently Asked Questions

What is the IUPAC name of 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol?
The IUPAC name of 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol (CID 82709739) is 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol.
What is the SMILES notation for 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol?
The canonical SMILES for 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol is CCONC(C)c1ccc2ccccc2c1O.
What is the InChIKey of 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol?
The InChIKey is BAWPYZWYZVSJJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-3-17-15-10(2)12-9-8-11-6-4-5-7-13(11)14(12)16/h4-10,15-16H,3H2,1-2H3.
What are the key properties of 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol?
2-[1-(ethoxyamino)ethyl]naphthalen-1-ol has a molecular weight of 231.29 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(ethoxyamino)ethyl]naphthalen-1-ol is sourced from PubChem (CID 82709739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).