N,N-dimethyl-4-naphthalen-1-yloxybutanamide

C16H19NO2 — CID 60769263

IUPACN,N-dimethyl-4-naphthalen-1-yloxybutanamide
SMILESCN(C)C(=O)CCCOc1cccc2ccccc12
InChIInChI=1S/C16H19NO2/c1-17(2)16(18)11-6-12-19-15-10-5-8-13-7-3-4-9-14(13)15/h3-5,7-10H,6,11-12H2,1-2H3
InChIKeyIGCJRQNWNUMQIM-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.09
Rot. Bonds5

About N,N-dimethyl-4-naphthalen-1-yloxybutanamide

N,N-dimethyl-4-naphthalen-1-yloxybutanamide (PubChem CID 60769263) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N,N-dimethyl-4-naphthalen-1-yloxybutanamide.

Molecular Properties

Compound NameN,N-dimethyl-4-naphthalen-1-yloxybutanamide
PubChem CID60769263
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN,N-dimethyl-4-naphthalen-1-yloxybutanamide
SMILESCN(C)C(=O)CCCOc1cccc2ccccc12
InChIInChI=1S/C16H19NO2/c1-17(2)16(18)11-6-12-19-15-10-5-8-13-7-3-4-9-14(13)15/h3-5,7-10H,6,11-12H2,1-2H3
InChIKeyIGCJRQNWNUMQIM-UHFFFAOYSA-N
XLogP3.09
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(2-hydroxyphenyl)methyl]-N-methyl-4-naphthalen-1-yloxybutanamide
CID 60518694
N',N'-dimethyl-3-naphthalen-1-yloxypropanehydrazide
CID 116820813
6-naphthalen-1-yloxyhex-1-en-3-one
CID 134187093
N-[[4-(dimethylamino)phenyl]methyl]-4-naphthalen-1-yloxybutanamide
CID 46469275
3-(4-aminonaphthalen-1-yl)oxy-N,N-dimethylpropanamide
CID 63691333
N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]-4-naphthalen-1-yloxybutanamide
CID 55718491
2-chloro-6-[4-(dimethylamino)-4-oxobutoxy]benzoic acid
CID 113276802
4-[2-[(1S)-1-hydroxypropyl]phenoxy]-N,N-dimethylbutanamide
CID 55189164
4-[(2-chloro-3-pyridinyl)oxy]-N,N-dimethylbutanamide
CID 65101759
N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]-4-naphthalen-1-yloxybutanamide
CID 55713133
1-butoxynaphthalene
CID 13262700
2-naphthalen-1-yloxyethyl acetate
CID 23049663

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-naphthalen-1-yloxybutanamide?
The IUPAC name of N,N-dimethyl-4-naphthalen-1-yloxybutanamide (CID 60769263) is N,N-dimethyl-4-naphthalen-1-yloxybutanamide.
What is the SMILES notation for N,N-dimethyl-4-naphthalen-1-yloxybutanamide?
The canonical SMILES for N,N-dimethyl-4-naphthalen-1-yloxybutanamide is CN(C)C(=O)CCCOc1cccc2ccccc12.
What is the InChIKey of N,N-dimethyl-4-naphthalen-1-yloxybutanamide?
The InChIKey is IGCJRQNWNUMQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-17(2)16(18)11-6-12-19-15-10-5-8-13-7-3-4-9-14(13)15/h3-5,7-10H,6,11-12H2,1-2H3.
What are the key properties of N,N-dimethyl-4-naphthalen-1-yloxybutanamide?
N,N-dimethyl-4-naphthalen-1-yloxybutanamide has a molecular weight of 257.33 g/mol, XLogP of 3.09, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-naphthalen-1-yloxybutanamide is sourced from PubChem (CID 60769263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).