N-benzyl-2-(methylamino)-N-propylacetamide

C13H20N2O — CID 43401552

IUPACN-benzyl-2-(methylamino)-N-propylacetamide
SMILESCCCN(Cc1ccccc1)C(=O)CNC
InChIInChI=1S/C13H20N2O/c1-3-9-15(13(16)10-14-2)11-12-7-5-4-6-8-12/h4-8,14H,3,9-11H2,1-2H3
InChIKeyFSVGNJKAMKZDKC-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.64
Rot. Bonds6

About N-benzyl-2-(methylamino)-N-propylacetamide

N-benzyl-2-(methylamino)-N-propylacetamide (PubChem CID 43401552) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-benzyl-2-(methylamino)-N-propylacetamide.

Molecular Properties

Compound NameN-benzyl-2-(methylamino)-N-propylacetamide
PubChem CID43401552
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-benzyl-2-(methylamino)-N-propylacetamide
SMILESCCCN(Cc1ccccc1)C(=O)CNC
InChIInChI=1S/C13H20N2O/c1-3-9-15(13(16)10-14-2)11-12-7-5-4-6-8-12/h4-8,14H,3,9-11H2,1-2H3
InChIKeyFSVGNJKAMKZDKC-UHFFFAOYSA-N
XLogP1.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-(2-hydroxyethyl)-2-(methylamino)acetamide
CID 58786294
2-(methylamino)-N-[(4-methylphenyl)methyl]-N-propylacetamide
CID 60686287
N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide
CID 54869876
N-benzyl-N-[2-(dimethylamino)ethyl]-2-(methylamino)acetamide;hydrochloride
CID 120703570
2-anilino-N-benzyl-N-propylacetamide;hydrochloride
CID 119681623
N-benzyl-N-propyl-2-(prop-2-ynylamino)acetamide
CID 78915073
N-benzyl-N-ethyl-N',N'-dipropylpropanediamide
CID 108947326
N-[2-[benzyl(propyl)amino]-2-oxoethyl]-2-methylbenzamide
CID 51186348
N-(2-amino-2-oxoethyl)-N-benzyl-2-(methylamino)acetamide;hydrochloride
CID 119783026
N-benzyl-N-(2,2-difluoroethyl)-2-(methylamino)acetamide
CID 119807964
N-benzyl-2-[(2-phenoxyacetyl)amino]-N-propylacetamide
CID 30586947
N-benzyl-2-(2-methoxyethylamino)-N-propylacetamide;hydrochloride
CID 119681638

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(methylamino)-N-propylacetamide?
The IUPAC name of N-benzyl-2-(methylamino)-N-propylacetamide (CID 43401552) is N-benzyl-2-(methylamino)-N-propylacetamide.
What is the SMILES notation for N-benzyl-2-(methylamino)-N-propylacetamide?
The canonical SMILES for N-benzyl-2-(methylamino)-N-propylacetamide is CCCN(Cc1ccccc1)C(=O)CNC.
What is the InChIKey of N-benzyl-2-(methylamino)-N-propylacetamide?
The InChIKey is FSVGNJKAMKZDKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-3-9-15(13(16)10-14-2)11-12-7-5-4-6-8-12/h4-8,14H,3,9-11H2,1-2H3.
What are the key properties of N-benzyl-2-(methylamino)-N-propylacetamide?
N-benzyl-2-(methylamino)-N-propylacetamide has a molecular weight of 220.32 g/mol, XLogP of 1.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(methylamino)-N-propylacetamide is sourced from PubChem (CID 43401552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).