N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide

C15H25N3O — CID 108994441

IUPACN-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide
SMILESCCN(Cc1ccccc1)C(=O)CNCCN(C)C
InChIInChI=1S/C15H25N3O/c1-4-18(13-14-8-6-5-7-9-14)15(19)12-16-10-11-17(2)3/h5-9,16H,4,10-13H2,1-3H3
InChIKeyBXMZRQYZYSVJDS-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.19
Rot. Bonds8

About N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide

N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide (PubChem CID 108994441) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide.

Molecular Properties

Compound NameN-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide
PubChem CID108994441
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide
SMILESCCN(Cc1ccccc1)C(=O)CNCCN(C)C
InChIInChI=1S/C15H25N3O/c1-4-18(13-14-8-6-5-7-9-14)15(19)12-16-10-11-17(2)3/h5-9,16H,4,10-13H2,1-3H3
InChIKeyBXMZRQYZYSVJDS-UHFFFAOYSA-N
XLogP1.19
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-N-ethyl-2-(propylamino)acetamide
CID 60687302
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254
N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide
CID 54869876
N-benzyl-2-(cyclopropylmethylamino)-N-[2-(dimethylamino)ethyl]acetamide
CID 60936936
N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride
CID 120703570
N-benzyl-N-ethyl-2-[2-(4-methoxyphenoxy)ethylamino]acetamide
CID 108998980
N-benzyl-N-ethyl-2-[(2-methoxyphenyl)methylamino]acetamide
CID 108998287
N-benzyl-2-(dimethylsulfamoylamino)-N-ethylacetamide
CID 47389495
N-benzyl-N-ethyl-N',N'-dipropylpropanediamide
CID 108947326
N-[2-[benzyl(ethyl)amino]-2-oxoethyl]-2-(2-methoxyethylamino)acetamide
CID 119750917
N-benzyl-2-[2-(3,4-dimethoxyphenyl)ethylamino]-N-ethylacetamide
CID 108998963
2-(benzylamino)-N,N-diethylacetamide
CID 10857021

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide?
The IUPAC name of N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide (CID 108994441) is N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide.
What is the SMILES notation for N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide?
The canonical SMILES for N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide is CCN(Cc1ccccc1)C(=O)CNCCN(C)C.
What is the InChIKey of N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide?
The InChIKey is BXMZRQYZYSVJDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-18(13-14-8-6-5-7-9-14)15(19)12-16-10-11-17(2)3/h5-9,16H,4,10-13H2,1-3H3.
What are the key properties of N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide?
N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide has a molecular weight of 263.38 g/mol, XLogP of 1.19, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide is sourced from PubChem (CID 108994441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).