ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide

C13H22N2O — CID 142212202

IUPACethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
SMILESCC.Cc1ccccc1CN(C)CC(N)=O
InChIInChI=1S/C11H16N2O.C2H6/c1-9-5-3-4-6-10(9)7-13(2)8-11(12)14;1-2/h3-6H,7-8H2,1-2H3,(H2,12,14);1-2H3
InChIKeyLQPFZPKZJJCBJQ-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.94
Rot. Bonds4

About ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide

ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide (PubChem CID 142212202) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide.

Molecular Properties

Compound Nameethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
PubChem CID142212202
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Nameethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
SMILESCC.Cc1ccccc1CN(C)CC(N)=O
InChIInChI=1S/C11H16N2O.C2H6/c1-9-5-3-4-6-10(9)7-13(2)8-11(12)14;1-2/h3-6H,7-8H2,1-2H3,(H2,12,14);1-2H3
InChIKeyLQPFZPKZJJCBJQ-UHFFFAOYSA-N
XLogP1.94
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluorophenyl)-3-[methyl-[(2-methylphenyl)methyl]amino]propan-2-one
CID 62036369
1-(3,4-dimethylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]ethanone
CID 60650744
2-[methyl-[(2-methylphenyl)methyl]amino]-N-propylacetamide
CID 47006716
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
CID 61370638
N-(2,6-diethylphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 8964124
2-[(3-carbamothioyl-2-fluorophenyl)methyl-methylamino]acetamide
CID 107115327
1-(4-methoxyphenyl)-2-[methyl-[(2-methylphenyl)methyl]amino]ethanone
CID 60650805
N-benzhydryl-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 8964153
N-butyl-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 78791395
4-(2-methylphenyl)butanamide
CID 22103596
1-(5-bromothiophen-2-yl)-2-[methyl-[(2-methylphenyl)methyl]amino]ethanone
CID 62036953
N-(2-cyanoethyl)-N-methyl-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 60690747

Frequently Asked Questions

What is the IUPAC name of ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide?
The IUPAC name of ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide (CID 142212202) is ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide.
What is the SMILES notation for ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide?
The canonical SMILES for ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide is CC.Cc1ccccc1CN(C)CC(N)=O.
What is the InChIKey of ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide?
The InChIKey is LQPFZPKZJJCBJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O.C2H6/c1-9-5-3-4-6-10(9)7-13(2)8-11(12)14;1-2/h3-6H,7-8H2,1-2H3,(H2,12,14);1-2H3.
What are the key properties of ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide?
ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide has a molecular weight of 222.33 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide is sourced from PubChem (CID 142212202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).