2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide

C21H21NO — CID 4807047

IUPAC2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide
SMILESO=C(Cc1cccc2ccccc12)NCCCc1ccccc1
InChIInChI=1S/C21H21NO/c23-21(22-15-7-10-17-8-2-1-3-9-17)16-19-13-6-12-18-11-4-5-14-20(18)19/h1-6,8-9,11-14H,7,10,15-16H2,(H,22,23)
InChIKeySRUWHXWYQSFVNY-UHFFFAOYSA-N
MW303.41 g/mol
LogP4.13
Rot. Bonds6

About 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide

2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide (PubChem CID 4807047) has the molecular formula C21H21NO and a molecular weight of 303.41 g/mol. Its IUPAC name is 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide
PubChem CID4807047
Molecular FormulaC21H21NO
Molecular Weight303.41 g/mol
Exact Mass303.16
IUPAC Name2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide
SMILESO=C(Cc1cccc2ccccc12)NCCCc1ccccc1
InChIInChI=1S/C21H21NO/c23-21(22-15-7-10-17-8-2-1-3-9-17)16-19-13-6-12-18-11-4-5-14-20(18)19/h1-6,8-9,11-14H,7,10,15-16H2,(H,22,23)
InChIKeySRUWHXWYQSFVNY-UHFFFAOYSA-N
XLogP4.13
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(3-bromopropyl)-2-naphthalen-1-ylacetamide
CID 43246333
N-butyl-2-naphthalen-1-ylacetamide
CID 56993604
N-(4-aminobutyl)-2-naphthalen-1-ylacetamide
CID 14751500
2-naphthalen-1-yl-N-octadecylacetamide
CID 71334923
N-(5-chloropentyl)-2-naphthalen-1-ylacetamide
CID 107321302
2-[(2-naphthalen-1-ylacetyl)amino]ethylazanium
CID 3827956
N-[3-(N-methylanilino)propyl]-2-naphthalen-1-ylacetamide
CID 27746775
N-(3,3-diphenylpropyl)-2-naphthalen-1-ylacetamide
CID 7935580
N-[3-[5-(4-aminobutylamino)pentylamino]propyl]-2-naphthalen-1-ylacetamide
CID 10000946
2-naphthalen-1-yl-N-(3-phenylpropylideneamino)acetamide
CID 5127526
N-[2-[2-aminoethyl(2-phenylethyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 120886692
N-(5-amino-4-methylpentyl)-2-naphthalen-1-ylacetamide
CID 106152740

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide?
The IUPAC name of 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide (CID 4807047) is 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide.
What is the SMILES notation for 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide?
The canonical SMILES for 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide is O=C(Cc1cccc2ccccc12)NCCCc1ccccc1.
What is the InChIKey of 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide?
The InChIKey is SRUWHXWYQSFVNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO/c23-21(22-15-7-10-17-8-2-1-3-9-17)16-19-13-6-12-18-11-4-5-14-20(18)19/h1-6,8-9,11-14H,7,10,15-16H2,(H,22,23).
What are the key properties of 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide?
2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide has a molecular weight of 303.41 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide is sourced from PubChem (CID 4807047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).