2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide

C26H33N3O — CID 70583478

IUPAC2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide
SMILESCCN(CC)c1cc(C(C(=O)Nc2ccccc2)N(CC)CC)cc2ccccc12
InChIInChI=1S/C26H33N3O/c1-5-28(6-2)24-19-21(18-20-14-12-13-17-23(20)24)25(29(7-3)8-4)26(30)27-22-15-10-9-11-16-22/h9-19,25H,5-8H2,1-4H3,(H,27,30)
InChIKeyKEORZOLAMPQRBW-UHFFFAOYSA-N
MW403.57 g/mol
LogP5.71
Rot. Bonds9

About 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide

2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide (PubChem CID 70583478) has the molecular formula C26H33N3O and a molecular weight of 403.57 g/mol. Its IUPAC name is 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide
PubChem CID70583478
Molecular FormulaC26H33N3O
Molecular Weight403.57 g/mol
Exact Mass403.26
IUPAC Name2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide
SMILESCCN(CC)c1cc(C(C(=O)Nc2ccccc2)N(CC)CC)cc2ccccc12
InChIInChI=1S/C26H33N3O/c1-5-28(6-2)24-19-21(18-20-14-12-13-17-23(20)24)25(29(7-3)8-4)26(30)27-22-15-10-9-11-16-22/h9-19,25H,5-8H2,1-4H3,(H,27,30)
InChIKeyKEORZOLAMPQRBW-UHFFFAOYSA-N
XLogP5.71
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.57
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide
CID 56538563
2-(diethylamino)-N-[4-(dimethylamino)-3-methylphenyl]-2-phenylacetamide
CID 56540512
N-[3-(tert-butylsulfamoyl)phenyl]-2-(diethylamino)-2-phenylacetamide
CID 56538153
4-[(2,2-diphenylacetyl)amino]-N-ethyl-N-naphthalen-1-ylbenzamide
CID 4940823
2-[[2-(2,6-difluoroanilino)-2-oxoethyl]-ethylamino]-N,2-diphenylacetamide
CID 112804241
2-[ethyl(2-hydroxyethyl)amino]-N-(4-fluorophenyl)-2-phenylacetamide
CID 110881216
2-(diethylamino)-N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-2-phenylacetamide
CID 56580511
2-(diethylamino)-N-[3-(5-methylpyrazol-1-yl)phenyl]-2-phenylacetamide
CID 56538997
N-[3-(cyclopropylsulfamoyl)phenyl]-2-(diethylamino)-2-phenylacetamide
CID 56581574
N-(4-bromo-2-methylphenyl)-2-(diethylamino)-2-phenylacetamide
CID 56538096
2-(diethylamino)-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-phenylacetamide
CID 56540390
2-[2-cyanopropyl(ethyl)amino]-N-phenylpropanamide
CID 54988244

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide?
The IUPAC name of 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide (CID 70583478) is 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide.
What is the SMILES notation for 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide?
The canonical SMILES for 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide is CCN(CC)c1cc(C(C(=O)Nc2ccccc2)N(CC)CC)cc2ccccc12.
What is the InChIKey of 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide?
The InChIKey is KEORZOLAMPQRBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N3O/c1-5-28(6-2)24-19-21(18-20-14-12-13-17-23(20)24)25(29(7-3)8-4)26(30)27-22-15-10-9-11-16-22/h9-19,25H,5-8H2,1-4H3,(H,27,30).
What are the key properties of 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide?
2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide has a molecular weight of 403.57 g/mol, XLogP of 5.71, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-2-[4-(diethylamino)naphthalen-2-yl]-N-phenylacetamide is sourced from PubChem (CID 70583478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).