N-benzyl-2-(dipropylamino)-N-ethylacetamide

C17H28N2O — CID 108998990

IUPACN-benzyl-2-(dipropylamino)-N-ethylacetamide
SMILESCCCN(CCC)CC(=O)N(CC)Cc1ccccc1
InChIInChI=1S/C17H28N2O/c1-4-12-18(13-5-2)15-17(20)19(6-3)14-16-10-8-7-9-11-16/h7-11H,4-6,12-15H2,1-3H3
InChIKeyMLTPIAXTMWKAJG-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.16
Rot. Bonds9

About N-benzyl-2-(dipropylamino)-N-ethylacetamide

N-benzyl-2-(dipropylamino)-N-ethylacetamide (PubChem CID 108998990) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-benzyl-2-(dipropylamino)-N-ethylacetamide.

Molecular Properties

Compound NameN-benzyl-2-(dipropylamino)-N-ethylacetamide
PubChem CID108998990
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-benzyl-2-(dipropylamino)-N-ethylacetamide
SMILESCCCN(CCC)CC(=O)N(CC)Cc1ccccc1
InChIInChI=1S/C17H28N2O/c1-4-12-18(13-5-2)15-17(20)19(6-3)14-16-10-8-7-9-11-16/h7-11H,4-6,12-15H2,1-3H3
InChIKeyMLTPIAXTMWKAJG-UHFFFAOYSA-N
XLogP3.16
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-ethyl-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 60685771
N-benzyl-N-ethyl-N',N'-dipropylpropanediamide
CID 108947326
2-[benzyl(propyl)amino]-N-(2-cyanopropyl)-N-ethylacetamide
CID 87013152
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254
N,N'-dibenzyl-N,N'-diethylpentanediamide
CID 68902262
N-benzyl-2-cyano-N-ethylacetamide
CID 28983811
2-[[2-[benzyl(ethyl)amino]-2-oxoethyl]-methylamino]acetamide
CID 56815139
N,N'-dibenzyl-N,N'-diethyloxamide
CID 3417048
2-[[2-[benzyl(ethyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
CID 60839143
2-[2-aminoethyl(benzyl)amino]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 106511560
N-benzyl-N-ethyl-2-(propylamino)acetamide
CID 60687302
2-[2-aminoethyl(2-phenylethyl)amino]-N,N-diethylacetamide;hydrochloride
CID 120871888

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(dipropylamino)-N-ethylacetamide?
The IUPAC name of N-benzyl-2-(dipropylamino)-N-ethylacetamide (CID 108998990) is N-benzyl-2-(dipropylamino)-N-ethylacetamide.
What is the SMILES notation for N-benzyl-2-(dipropylamino)-N-ethylacetamide?
The canonical SMILES for N-benzyl-2-(dipropylamino)-N-ethylacetamide is CCCN(CCC)CC(=O)N(CC)Cc1ccccc1.
What is the InChIKey of N-benzyl-2-(dipropylamino)-N-ethylacetamide?
The InChIKey is MLTPIAXTMWKAJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-4-12-18(13-5-2)15-17(20)19(6-3)14-16-10-8-7-9-11-16/h7-11H,4-6,12-15H2,1-3H3.
What are the key properties of N-benzyl-2-(dipropylamino)-N-ethylacetamide?
N-benzyl-2-(dipropylamino)-N-ethylacetamide has a molecular weight of 276.42 g/mol, XLogP of 3.16, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(dipropylamino)-N-ethylacetamide is sourced from PubChem (CID 108998990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).