2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride

C14H22ClN3O2 — CID 119267479

IUPAC2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride
SMILESCCCN(CC(=O)Nc1ccccc1C)C(=O)CN.Cl
InChIInChI=1S/C14H21N3O2.ClH/c1-3-8-17(14(19)9-15)10-13(18)16-12-7-5-4-6-11(12)2;/h4-7H,3,8-10,15H2,1-2H3,(H,16,18);1H
InChIKeyZPIQCUALXFPJHB-UHFFFAOYSA-N
MW299.80 g/mol
LogP1.55
Rot. Bonds6

About 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride

2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride (PubChem CID 119267479) has the molecular formula C14H22ClN3O2 and a molecular weight of 299.80 g/mol. Its IUPAC name is 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride
PubChem CID119267479
Molecular FormulaC14H22ClN3O2
Molecular Weight299.80 g/mol
Exact Mass299.14
IUPAC Name2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride
SMILESCCCN(CC(=O)Nc1ccccc1C)C(=O)CN.Cl
InChIInChI=1S/C14H21N3O2.ClH/c1-3-8-17(14(19)9-15)10-13(18)16-12-7-5-4-6-11(12)2;/h4-7H,3,8-10,15H2,1-2H3,(H,16,18);1H
InChIKeyZPIQCUALXFPJHB-UHFFFAOYSA-N
XLogP1.55
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylacetamide
CID 119267704
2-methyl-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylcyclopropane-1-carboxamide
CID 42990004
2-ethyl-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylbutanamide
CID 112790013
N-[3-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-3-oxopropyl]benzamide
CID 38676277
[2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 30044360
2-(1H-indol-3-yl)-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide
CID 25161690
2-[[2-(2-ethylphenoxy)acetyl]-propylamino]-N-(2-methylphenyl)acetamide
CID 55327341
N-[2-(2-methylanilino)-2-oxoethyl]-2-[1-(2-methylphenyl)ethylamino]-N-propylacetamide
CID 112801015
2-[[2-[methyl-[(4-methylphenyl)methyl]amino]acetyl]-propylamino]-N-(2-methylphenyl)acetamide
CID 112800275
2-(2-methoxyethylamino)-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide
CID 119682407
2-(dibutylamino)-N-(2-methylphenyl)acetamide;hydrochloride
CID 3026049
4-(4-chlorophenyl)-N-[2-(2-methylanilino)-2-oxoethyl]-4-oxo-N-propylbutanamide
CID 31974383

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride (CID 119267479) is 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride is CCCN(CC(=O)Nc1ccccc1C)C(=O)CN.Cl.
What is the InChIKey of 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride?
The InChIKey is ZPIQCUALXFPJHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2.ClH/c1-3-8-17(14(19)9-15)10-13(18)16-12-7-5-4-6-11(12)2;/h4-7H,3,8-10,15H2,1-2H3,(H,16,18);1H.
What are the key properties of 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride?
2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride has a molecular weight of 299.80 g/mol, XLogP of 1.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride is sourced from PubChem (CID 119267479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).