2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide

C19H25N3O — CID 108994706

IUPAC2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide
SMILESCN(C)CCNC(=O)CN(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C19H25N3O/c1-21(2)14-13-20-19(23)16-22(18-11-7-4-8-12-18)15-17-9-5-3-6-10-17/h3-12H,13-16H2,1-2H3,(H,20,23)
InChIKeyGJLFIUMYFBMVHH-UHFFFAOYSA-N
MW311.43 g/mol
LogP2.37
Rot. Bonds8

About 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide

2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide (PubChem CID 108994706) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide
PubChem CID108994706
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide
SMILESCN(C)CCNC(=O)CN(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C19H25N3O/c1-21(2)14-13-20-19(23)16-22(18-11-7-4-8-12-18)15-17-9-5-3-6-10-17/h3-12H,13-16H2,1-2H3,(H,20,23)
InChIKeyGJLFIUMYFBMVHH-UHFFFAOYSA-N
XLogP2.37
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-benzylanilino)-N-(3-methylbutyl)acetamide
CID 109005918
N-[2-(dimethylamino)ethyl]-2-(N-methylanilino)acetamide
CID 108994641
N-[3-(dimethylamino)propyl]-2-(N-ethylanilino)acetamide
CID 108995270
N-(2-acetamidoethyl)-2-(N-benzyl-4-methylanilino)acetamide
CID 78825845
2-[benzyl-(3-benzyl-1,2,4-thiadiazol-5-yl)amino]-N-[2-(dimethylamino)ethyl]acetamide
CID 4545934
2-(N-benzyl-4-methoxyanilino)-N-propylacetamide
CID 18166490
N-[2-(dimethylamino)ethyl]-3-(N-methylanilino)propanamide
CID 109016239
N'-benzyl-N-[2-(dimethylamino)ethyl]butanediamide
CID 3296654
2-(N-benzylanilino)-N-(4-methylphenyl)acetamide
CID 109007221
2-[N-(2-hydroxyethyl)anilino]-N-(2-phenylethyl)acetamide
CID 110877202
2-[benzyl(propan-2-yl)amino]-N-[3-(dimethylamino)propyl]acetamide
CID 108995244
2-(N-benzylanilino)-N,N-diethylacetamide
CID 109005016

Frequently Asked Questions

What is the IUPAC name of 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide?
The IUPAC name of 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide (CID 108994706) is 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide.
What is the SMILES notation for 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide?
The canonical SMILES for 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide is CN(C)CCNC(=O)CN(Cc1ccccc1)c1ccccc1.
What is the InChIKey of 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide?
The InChIKey is GJLFIUMYFBMVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-21(2)14-13-20-19(23)16-22(18-11-7-4-8-12-18)15-17-9-5-3-6-10-17/h3-12H,13-16H2,1-2H3,(H,20,23).
What are the key properties of 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide?
2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide has a molecular weight of 311.43 g/mol, XLogP of 2.37, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-benzylanilino)-N-[2-(dimethylamino)ethyl]acetamide is sourced from PubChem (CID 108994706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).