4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide

C27H24N2O3 — CID 1194588

IUPAC4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide
SMILESO=C(COc1ccc(C(=O)NCCc2ccccc2)cc1)Nc1cccc2ccccc12
InChIInChI=1S/C27H24N2O3/c30-26(29-25-12-6-10-21-9-4-5-11-24(21)25)19-32-23-15-13-22(14-16-23)27(31)28-18-17-20-7-2-1-3-8-20/h1-16H,17-19H2,(H,28,31)(H,29,30)
InChIKeyDTRVPEKDNIXYAA-UHFFFAOYSA-N
MW424.50 g/mol
LogP4.83
Rot. Bonds8

About 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide

4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide (PubChem CID 1194588) has the molecular formula C27H24N2O3 and a molecular weight of 424.50 g/mol. Its IUPAC name is 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound Name4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide
PubChem CID1194588
Molecular FormulaC27H24N2O3
Molecular Weight424.50 g/mol
Exact Mass424.18
IUPAC Name4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide
SMILESO=C(COc1ccc(C(=O)NCCc2ccccc2)cc1)Nc1cccc2ccccc12
InChIInChI=1S/C27H24N2O3/c30-26(29-25-12-6-10-21-9-4-5-11-24(21)25)19-32-23-15-13-22(14-16-23)27(31)28-18-17-20-7-2-1-3-8-20/h1-16H,17-19H2,(H,28,31)(H,29,30)
InChIKeyDTRVPEKDNIXYAA-UHFFFAOYSA-N
XLogP4.83
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.50
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-oxo-2-[2-(trifluoromethyl)anilino]ethoxy]-N-(2-phenylethyl)benzamide
CID 1182090
N-benzyl-4-[2-(2-fluoroanilino)-2-oxoethoxy]benzamide
CID 1182077
N-naphthalen-1-yl-2-(4-propanoylphenoxy)acetamide
CID 7044052
2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(2-phenylethyl)benzamide
CID 29446930
4-(2-methylprop-2-enoxy)-N-(2-phenylethyl)benzamide
CID 17123750
4-(2-methoxyethoxy)-N-(2-phenylethyl)benzamide
CID 15943281
1-N,4-N-bis(2-phenylethyl)benzene-1,4-dicarboxamide
CID 984633
N-(3-amino-3-oxopropyl)-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]benzamide
CID 56573020
2-[4-(3-methylbutoxy)phenoxy]-N-naphthalen-1-ylacetamide
CID 4732901
N-(naphthalen-1-ylcarbamothioyl)-4-phenylmethoxybenzamide
CID 22775968
2-[4-[(2S)-butan-2-yl]phenoxy]-N-naphthalen-1-ylacetamide
CID 918616
N-benzyl-4-[[2-(4-phenylphenoxy)acetyl]amino]benzamide
CID 28639925

Frequently Asked Questions

What is the IUPAC name of 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide?
The IUPAC name of 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide (CID 1194588) is 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide.
What is the SMILES notation for 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide?
The canonical SMILES for 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide is O=C(COc1ccc(C(=O)NCCc2ccccc2)cc1)Nc1cccc2ccccc12.
What is the InChIKey of 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide?
The InChIKey is DTRVPEKDNIXYAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N2O3/c30-26(29-25-12-6-10-21-9-4-5-11-24(21)25)19-32-23-15-13-22(14-16-23)27(31)28-18-17-20-7-2-1-3-8-20/h1-16H,17-19H2,(H,28,31)(H,29,30).
What are the key properties of 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide?
4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide has a molecular weight of 424.50 g/mol, XLogP of 4.83, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(naphthalen-1-ylamino)-2-oxoethoxy]-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 1194588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).