N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide

C12H16Cl2N2O — CID 119584839

IUPACN-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide
SMILESCC(CN)N(C)C(=O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C12H16Cl2N2O/c1-8(7-15)16(2)12(17)6-9-10(13)4-3-5-11(9)14/h3-5,8H,6-7,15H2,1-2H3
InChIKeyMBTAMCUYMSXRFP-UHFFFAOYSA-N
MW275.18 g/mol
LogP2.34
Rot. Bonds4

About N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide

N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide (PubChem CID 119584839) has the molecular formula C12H16Cl2N2O and a molecular weight of 275.18 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide
PubChem CID119584839
Molecular FormulaC12H16Cl2N2O
Molecular Weight275.18 g/mol
Exact Mass274.06
IUPAC NameN-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide
SMILESCC(CN)N(C)C(=O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C12H16Cl2N2O/c1-8(7-15)16(2)12(17)6-9-10(13)4-3-5-11(9)14/h3-5,8H,6-7,15H2,1-2H3
InChIKeyMBTAMCUYMSXRFP-UHFFFAOYSA-N
XLogP2.34
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide 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

N-(1-aminopropan-2-yl)-2-(2,6-dimethoxyphenyl)-N-methylacetamide
CID 119583792
2-(2-chloro-6-fluorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 112704720
2-(2-chloro-6-fluorophenyl)-N-[(2S)-1-ethylsulfonylpropan-2-yl]-N-methylacetamide
CID 95625361
N-(1-aminopropan-2-yl)-2-(2-chlorophenoxy)-N-methylacetamide;hydrochloride
CID 119583328
N-(1-aminopropan-2-yl)-2-[3-[(2-chlorophenyl)methoxy]phenyl]-N-methylacetamide;hydrochloride
CID 119583694
N-(1-aminopropan-2-yl)-2-(8-chloronaphthalen-1-yl)sulfanyl-N-methylacetamide;hydrochloride
CID 119581746
N-(1-aminopropan-2-yl)-4-(2,3-dichlorophenoxy)-N-methylbutanamide;hydrochloride
CID 119584124
N-(1-aminopropan-2-yl)-N-methyl-2-[4-(2-methylpropyl)phenyl]acetamide
CID 119583475
N-(1-aminopropan-2-yl)-2-(4-fluorophenyl)-N-methylacetamide
CID 115733563
2-(2,6-dichlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylacetamide
CID 113476141
N-(1-aminopropan-2-yl)-2-[(2,4-dichlorophenyl)methylsulfanyl]-N-methylacetamide
CID 119582608
N-(1-aminopropan-2-yl)-N-methyl-2-(2-propan-2-yloxyphenyl)acetamide
CID 119582125

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide?
The IUPAC name of N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide (CID 119584839) is N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide is CC(CN)N(C)C(=O)Cc1c(Cl)cccc1Cl.
What is the InChIKey of N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide?
The InChIKey is MBTAMCUYMSXRFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O/c1-8(7-15)16(2)12(17)6-9-10(13)4-3-5-11(9)14/h3-5,8H,6-7,15H2,1-2H3.
What are the key properties of N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide?
N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide has a molecular weight of 275.18 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide is sourced from PubChem (CID 119584839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).