3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide

C16H20N2O2 — CID 119694969

IUPAC3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide
SMILESCC(N)CC(=O)NCCOc1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O2/c1-12(17)10-16(19)18-8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,11-12H,8-10,17H2,1H3,(H,18,19)
InChIKeyACCZXCFIGWBQAN-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.07
Rot. Bonds6

About 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide

3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide (PubChem CID 119694969) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide.

Molecular Properties

Compound Name3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide
PubChem CID119694969
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide
SMILESCC(N)CC(=O)NCCOc1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O2/c1-12(17)10-16(19)18-8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,11-12H,8-10,17H2,1H3,(H,18,19)
InChIKeyACCZXCFIGWBQAN-UHFFFAOYSA-N
XLogP2.07
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[methyl-[2-(2-naphthalen-2-yloxyethylamino)-2-oxoethyl]amino]acetamide
CID 56818402
1-(2-naphthalen-2-yloxyethyl)-3-propylurea
CID 95904010
methyl 2-amino-4-naphthalen-2-yloxybutanoate
CID 63041604
1-amino-N-(2-naphthalen-2-yloxyethyl)cyclopentane-1-carboxamide
CID 119274156
[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 9491672
2-(4-methylphenyl)sulfanyl-N-(2-naphthalen-2-yloxyethyl)propanamide
CID 133231200
2-(3,5-dimethylphenoxy)-N-(2-naphthalen-2-yloxyethyl)butanamide
CID 133252076
1-amino-N-(2-naphthalen-2-yloxyethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119274155
N-[2-(4-ethylphenoxy)ethyl]-2-naphthalen-2-yloxypropanamide
CID 133164555
N-[2-(3-methoxyphenoxy)ethyl]-3-methylbutanamide
CID 113099793
N-(3-ethoxypropyl)-2-naphthalen-2-yloxyacetamide
CID 35292228
N-[2-[di(propan-2-yl)amino]ethyl]-2-naphthalen-2-yloxyacetamide
CID 8919238

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide?
The IUPAC name of 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide (CID 119694969) is 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide.
What is the SMILES notation for 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide?
The canonical SMILES for 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide is CC(N)CC(=O)NCCOc1ccc2ccccc2c1.
What is the InChIKey of 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide?
The InChIKey is ACCZXCFIGWBQAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12(17)10-16(19)18-8-9-20-15-7-6-13-4-2-3-5-14(13)11-15/h2-7,11-12H,8-10,17H2,1H3,(H,18,19).
What are the key properties of 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide?
3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide has a molecular weight of 272.35 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-naphthalen-2-yloxyethyl)butanamide is sourced from PubChem (CID 119694969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).