3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide

C13H20N2O — CID 28795015

IUPAC3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide
SMILESCCc1cccc(C)c1N(C)C(=O)CCN
InChIInChI=1S/C13H20N2O/c1-4-11-7-5-6-10(2)13(11)15(3)12(16)8-9-14/h5-7H,4,8-9,14H2,1-3H3
InChIKeyGGNPTQNZMTZADS-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.87
Rot. Bonds4

About 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide

3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide (PubChem CID 28795015) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide
PubChem CID28795015
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide
SMILESCCc1cccc(C)c1N(C)C(=O)CCN
InChIInChI=1S/C13H20N2O/c1-4-11-7-5-6-10(2)13(11)15(3)12(16)8-9-14/h5-7H,4,8-9,14H2,1-3H3
InChIKeyGGNPTQNZMTZADS-UHFFFAOYSA-N
XLogP1.87
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2,6-diethylphenyl)-N-ethylpropanamide
CID 28795326
N'-(2-ethyl-6-methylphenyl)-N'-methylethane-1,2-diamine
CID 28772632
3-amino-N-methyl-N-(2-methylphenyl)propanamide
CID 28794972
N-(2,6-dimethylphenyl)-2-hydroxy-N-methylacetamide
CID 70578533
1-amino-1-(2-ethyl-6-methylphenyl)thiourea
CID 20849979
2-(N-(2-chloroacetyl)-2-ethyl-6-methylanilino)-N-hydroxy-N-methylacetamide
CID 12810720
ethyl 2-cyano-3-(2-ethyl-N,6-dimethylanilino)prop-2-enoate
CID 3589283
3-[N-[3-(dimethylamino)propyl]-2-ethyl-6-methylanilino]propanoic acid
CID 82319983
ethyl 2-(N-(2-ethoxy-2-oxoethyl)-2,6-diethylanilino)acetate
CID 57065804
methyl 2-(2-ethyl-6-methyl-N-(2-phenylacetyl)anilino)propanoate
CID 71156862
N-(2-ethyl-6-methylphenyl)-N-[(methylcarbamoylamino)methyl]butanamide
CID 134124662
2-[N-(ethoxymethyl)-2-ethyl-6-methylanilino]-2-oxoacetic acid
CID 15842091

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide?
The IUPAC name of 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide (CID 28795015) is 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide.
What is the SMILES notation for 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide?
The canonical SMILES for 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide is CCc1cccc(C)c1N(C)C(=O)CCN.
What is the InChIKey of 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide?
The InChIKey is GGNPTQNZMTZADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-11-7-5-6-10(2)13(11)15(3)12(16)8-9-14/h5-7H,4,8-9,14H2,1-3H3.
What are the key properties of 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide?
3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide has a molecular weight of 220.32 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethyl-6-methylphenyl)-N-methylpropanamide is sourced from PubChem (CID 28795015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).