N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide

C15H18N2O2 — CID 62656875

IUPACN-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide
SMILESCCNCCNC(=O)c1ccc2ccccc2c1O
InChIInChI=1S/C15H18N2O2/c1-2-16-9-10-17-15(19)13-8-7-11-5-3-4-6-12(11)14(13)18/h3-8,16,18H,2,9-10H2,1H3,(H,17,19)
InChIKeyWNDREYFBKUEHCL-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.88
Rot. Bonds5

About N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide

N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide (PubChem CID 62656875) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide
PubChem CID62656875
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide
SMILESCCNCCNC(=O)c1ccc2ccccc2c1O
InChIInChI=1S/C15H18N2O2/c1-2-16-9-10-17-15(19)13-8-7-11-5-3-4-6-12(11)14(13)18/h3-8,16,18H,2,9-10H2,1H3,(H,17,19)
InChIKeyWNDREYFBKUEHCL-UHFFFAOYSA-N
XLogP1.88
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-acetyl-N-[2-(ethylamino)ethyl]benzamide;hydrochloride
CID 119504668
1-hydroxy-N-(2-methylsulfinylethyl)naphthalene-2-carboxamide
CID 115633303
N-but-2-ynyl-1-hydroxynaphthalene-2-carboxamide
CID 113342440
1-hydroxy-N-(5-hydroxy-4-methylpentyl)naphthalene-2-carboxamide
CID 103864730
N-[2-(ethylamino)ethyl]-2,6-dimethylpyridine-3-carboxamide;dihydrochloride
CID 119508405
N-(2-cyclopentylethyl)-1-hydroxynaphthalene-2-carboxamide
CID 63524506
N-[2-(ethylamino)ethyl]-2-hydroxy-3-methoxybenzamide
CID 62656877
2-ethoxy-N-[2-(ethylamino)ethyl]benzamide;hydrochloride
CID 119508383
N-[2-(ethylamino)ethyl]-2-naphthalen-2-ylacetamide;hydrochloride
CID 119504641
N-[2-(ethylamino)ethyl]-4-hydroxy-1-methyl-2-oxoquinoline-3-carboxamide;hydrochloride
CID 56684063
N-[2-(ethylamino)ethyl]-2-hydroxy-4-methylbenzamide
CID 62656871
N-[2-(ethylamino)ethyl]-2-(thiophene-2-carbonyl)benzamide;hydrochloride
CID 119508490

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide (CID 62656875) is N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide is CCNCCNC(=O)c1ccc2ccccc2c1O.
What is the InChIKey of N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide?
The InChIKey is WNDREYFBKUEHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-16-9-10-17-15(19)13-8-7-11-5-3-4-6-12(11)14(13)18/h3-8,16,18H,2,9-10H2,1H3,(H,17,19).
What are the key properties of N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide?
N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.88, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)ethyl]-1-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 62656875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).