N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride

C14H24ClN3O — CID 120703570

IUPACN-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)N(CCN(C)C)Cc1ccccc1.Cl
InChIInChI=1S/C14H23N3O.ClH/c1-15-11-14(18)17(10-9-16(2)3)12-13-7-5-4-6-8-13;/h4-8,15H,9-12H2,1-3H3;1H
InChIKeyDQGXFJXTJOBFDP-UHFFFAOYSA-N
MW285.82 g/mol
LogP1.22
Rot. Bonds7

About N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride

N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride (PubChem CID 120703570) has the molecular formula C14H24ClN3O and a molecular weight of 285.82 g/mol. Its IUPAC name is N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride
PubChem CID120703570
Molecular FormulaC14H24ClN3O
Molecular Weight285.82 g/mol
Exact Mass285.16
IUPAC NameN-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)N(CCN(C)C)Cc1ccccc1.Cl
InChIInChI=1S/C14H23N3O.ClH/c1-15-11-14(18)17(10-9-16(2)3)12-13-7-5-4-6-8-13;/h4-8,15H,9-12H2,1-3H3;1H
InChIKeyDQGXFJXTJOBFDP-UHFFFAOYSA-N
XLogP1.22
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.82
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide
CID 54869876
N-[2-(dimethylamino)ethyl]-N-[(4-fluorophenyl)methyl]-2-(methylamino)acetamide;hydrochloride
CID 120705142
N-benzyl-2-(methylamino)-N-propylacetamide
CID 43401552
N-benzyl-N-(2-hydroxyethyl)-2-(methylamino)acetamide
CID 58786294
N-[(4-bromophenyl)methyl]-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide
CID 120705145
N-benzyl-N-[2-(dimethylamino)ethyl]-3-oxobutanamide
CID 54876796
N-benzyl-2-(cyclopropylmethylamino)-N-[2-(dimethylamino)ethyl]acetamide
CID 60936936
N-(2-amino-2-oxoethyl)-N-benzyl-2-(methylamino)acetamide;hydrochloride
CID 119783026
N-benzyl-2-[2-(dimethylamino)ethylamino]-N-ethylacetamide
CID 108994441
N-benzyl-N-(2,2-difluoroethyl)-2-(methylamino)acetamide
CID 119807964
N-benzyl-N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide
CID 79200837
2-anilino-N-benzyl-N-propylacetamide;hydrochloride
CID 119681623

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride (CID 120703570) is N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride is CNCC(=O)N(CCN(C)C)Cc1ccccc1.Cl.
What is the InChIKey of N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride?
The InChIKey is DQGXFJXTJOBFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O.ClH/c1-15-11-14(18)17(10-9-16(2)3)12-13-7-5-4-6-8-13;/h4-8,15H,9-12H2,1-3H3;1H.
What are the key properties of N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride?
N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride has a molecular weight of 285.82 g/mol, XLogP of 1.22, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 120703570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).