2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide

C17H27N3O2 — CID 86919152

IUPAC2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide
SMILESCc1ccccc1C(C)NC(=O)C(C)N(C)CC(=O)N(C)C
InChIInChI=1S/C17H27N3O2/c1-12-9-7-8-10-15(12)13(2)18-17(22)14(3)20(6)11-16(21)19(4)5/h7-10,13-14H,11H2,1-6H3,(H,18,22)
InChIKeyQWAGKJWCSWVXPV-UHFFFAOYSA-N
MW305.42 g/mol
LogP1.58
Rot. Bonds6

About 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide

2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide (PubChem CID 86919152) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide
PubChem CID86919152
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC Name2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide
SMILESCc1ccccc1C(C)NC(=O)C(C)N(C)CC(=O)N(C)C
InChIInChI=1S/C17H27N3O2/c1-12-9-7-8-10-15(12)13(2)18-17(22)14(3)20(6)11-16(21)19(4)5/h7-10,13-14H,11H2,1-6H3,(H,18,22)
InChIKeyQWAGKJWCSWVXPV-UHFFFAOYSA-N
XLogP1.58
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[methyl-[1-[1-(2-methylphenyl)ethylamino]-1-oxopropan-2-yl]amino]propanoic acid
CID 119911517
ethyl 2-amino-3-[[(1S)-1-(2-methylphenyl)ethyl]amino]-3-oxopropanoate
CID 104877641
2-methoxy-N-[1-(2-methylphenyl)ethyl]propanamide
CID 112685603
2-[methyl-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]amino]acetic acid
CID 43442483
2-amino-N-[1-(2-methylphenyl)ethyl]butanediamide
CID 61259896
(2R)-2-[(2-amino-2-oxoethyl)-methylamino]-N-[(1R)-1-phenylethyl]propanamide
CID 94150043
2-bromo-N-[(1S)-1-(2-methylphenyl)ethyl]acetamide
CID 81374930
N-[1-(2-methylphenyl)ethyl]-3-oxobutanamide
CID 18071549
2-amino-3-methoxy-N-[1-(2-methylphenyl)ethyl]propanamide;hydrochloride
CID 120983404
3-amino-N-[(1R)-1-(2-methylphenyl)ethyl]-2-phenylpropanamide
CID 81363517
methyl N-[1-(2-methylphenyl)ethyl]carbamate
CID 112683657
N-[1-(2-methylphenyl)ethyl]-2-phenylacetamide
CID 59082083

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide?
The IUPAC name of 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide (CID 86919152) is 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide.
What is the SMILES notation for 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide?
The canonical SMILES for 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide is Cc1ccccc1C(C)NC(=O)C(C)N(C)CC(=O)N(C)C.
What is the InChIKey of 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide?
The InChIKey is QWAGKJWCSWVXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-12-9-7-8-10-15(12)13(2)18-17(22)14(3)20(6)11-16(21)19(4)5/h7-10,13-14H,11H2,1-6H3,(H,18,22).
What are the key properties of 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide?
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide has a molecular weight of 305.42 g/mol, XLogP of 1.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[1-(2-methylphenyl)ethyl]propanamide is sourced from PubChem (CID 86919152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).