N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide

C24H28N2O2 — CID 54809387

IUPACN-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
SMILESCCCCCCOc1ccc(NC(=O)CNc2cccc3ccccc23)cc1
InChIInChI=1S/C24H28N2O2/c1-2-3-4-7-17-28-21-15-13-20(14-16-21)26-24(27)18-25-23-12-8-10-19-9-5-6-11-22(19)23/h5-6,8-16,25H,2-4,7,17-18H2,1H3,(H,26,27)
InChIKeyNOUGPKLRHDUDOR-UHFFFAOYSA-N
MW376.50 g/mol
LogP5.85
Rot. Bonds10

About N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide

N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide (PubChem CID 54809387) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide.

Molecular Properties

Compound NameN-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
PubChem CID54809387
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC NameN-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
SMILESCCCCCCOc1ccc(NC(=O)CNc2cccc3ccccc23)cc1
InChIInChI=1S/C24H28N2O2/c1-2-3-4-7-17-28-21-15-13-20(14-16-21)26-24(27)18-25-23-12-8-10-19-9-5-6-11-22(19)23/h5-6,8-16,25H,2-4,7,17-18H2,1H3,(H,26,27)
InChIKeyNOUGPKLRHDUDOR-UHFFFAOYSA-N
XLogP5.85
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.50
LogP ≤ 55.85
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

N-(3-heptoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
CID 54809079
N-[4-[[2-(4-hexoxyanilino)-2-oxoethyl]amino]phenyl]butanamide
CID 54837237
N-[4-[[2-(4-heptoxyanilino)-2-oxoethyl]amino]phenyl]butanamide
CID 54836845
2-(2,3-dichloroanilino)-N-(4-hexoxyphenyl)acetamide
CID 54815954
N-[4-(2-methylpropoxy)phenyl]-2-(naphthalen-1-ylamino)acetamide
CID 54809414
N-(2-butoxyphenyl)-2-(4-heptoxyanilino)acetamide
CID 54822084
2-(2-butoxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54828232
1-(4-butoxyphenyl)-3-naphthalen-1-ylurea
CID 4146159
2-(4-heptoxyanilino)-N-(4-phenoxyphenyl)acetamide
CID 54821713
N-(4-decoxyphenyl)butanamide
CID 143303175
N-(4-butoxyphenyl)-2-(naphthalen-2-ylamino)acetamide
CID 54839857
2-(4-ethoxyanilino)-N-(4-heptoxyphenyl)acetamide
CID 54811590

Frequently Asked Questions

What is the IUPAC name of N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The IUPAC name of N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide (CID 54809387) is N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide.
What is the SMILES notation for N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The canonical SMILES for N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide is CCCCCCOc1ccc(NC(=O)CNc2cccc3ccccc23)cc1.
What is the InChIKey of N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The InChIKey is NOUGPKLRHDUDOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c1-2-3-4-7-17-28-21-15-13-20(14-16-21)26-24(27)18-25-23-12-8-10-19-9-5-6-11-22(19)23/h5-6,8-16,25H,2-4,7,17-18H2,1H3,(H,26,27).
What are the key properties of N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide has a molecular weight of 376.50 g/mol, XLogP of 5.85, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hexoxyphenyl)-2-(naphthalen-1-ylamino)acetamide is sourced from PubChem (CID 54809387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).