N-(4-aminobutyl)-2-naphthalen-1-ylacetamide

C16H20N2O — CID 14751500

IUPACN-(4-aminobutyl)-2-naphthalen-1-ylacetamide
SMILESNCCCCNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C16H20N2O/c17-10-3-4-11-18-16(19)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-2,5-9H,3-4,10-12,17H2,(H,18,19)
InChIKeyBFERMAXUBSJHPF-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.24
Rot. Bonds6

About N-(4-aminobutyl)-2-naphthalen-1-ylacetamide

N-(4-aminobutyl)-2-naphthalen-1-ylacetamide (PubChem CID 14751500) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(4-aminobutyl)-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-(4-aminobutyl)-2-naphthalen-1-ylacetamide
PubChem CID14751500
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-(4-aminobutyl)-2-naphthalen-1-ylacetamide
SMILESNCCCCNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C16H20N2O/c17-10-3-4-11-18-16(19)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-2,5-9H,3-4,10-12,17H2,(H,18,19)
InChIKeyBFERMAXUBSJHPF-UHFFFAOYSA-N
XLogP2.24
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[3-[5-(4-aminobutylamino)pentylamino]propyl]-2-naphthalen-1-ylacetamide
CID 10000946
2-naphthalen-1-yl-N-octadecylacetamide
CID 71334923
N-(5-chloropentyl)-2-naphthalen-1-ylacetamide
CID 107321302
N-butyl-2-naphthalen-1-ylacetamide
CID 56993604
N-(3-bromopropyl)-2-naphthalen-1-ylacetamide
CID 43246333
N-(5-amino-4-methylpentyl)-2-naphthalen-1-ylacetamide
CID 106152740
2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide
CID 4807047
N-(4-aminobutyl)-2-(2-methylphenyl)acetamide
CID 60893782
2-[(2-naphthalen-1-ylacetyl)amino]ethylazanium
CID 3827956
2-[2-(4-aminobutylamino)-2-oxoethyl]benzoic acid
CID 113431497
N'-[4-(naphthalen-1-ylmethylamino)butyl]butane-1,4-diamine
CID 11255033
N-(2-amino-2-oxoethyl)-2-naphthalen-1-ylacetamide
CID 9294847

Frequently Asked Questions

What is the IUPAC name of N-(4-aminobutyl)-2-naphthalen-1-ylacetamide?
The IUPAC name of N-(4-aminobutyl)-2-naphthalen-1-ylacetamide (CID 14751500) is N-(4-aminobutyl)-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-(4-aminobutyl)-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-(4-aminobutyl)-2-naphthalen-1-ylacetamide is NCCCCNC(=O)Cc1cccc2ccccc12.
What is the InChIKey of N-(4-aminobutyl)-2-naphthalen-1-ylacetamide?
The InChIKey is BFERMAXUBSJHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c17-10-3-4-11-18-16(19)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-2,5-9H,3-4,10-12,17H2,(H,18,19).
What are the key properties of N-(4-aminobutyl)-2-naphthalen-1-ylacetamide?
N-(4-aminobutyl)-2-naphthalen-1-ylacetamide has a molecular weight of 256.35 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminobutyl)-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 14751500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).