2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide

C11H16N2O — CID 60913954

IUPAC2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide
SMILESCNCC(=O)NCc1cccc(C)c1
InChIInChI=1S/C11H16N2O/c1-9-4-3-5-10(6-9)7-13-11(14)8-12-2/h3-6,12H,7-8H2,1-2H3,(H,13,14)
InChIKeyQGDNIUHJZGHEDX-UHFFFAOYSA-N
MW192.26 g/mol
LogP0.83
Rot. Bonds4

About 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide

2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide (PubChem CID 60913954) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide
PubChem CID60913954
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide
SMILESCNCC(=O)NCc1cccc(C)c1
InChIInChI=1S/C11H16N2O/c1-9-4-3-5-10(6-9)7-13-11(14)8-12-2/h3-6,12H,7-8H2,1-2H3,(H,13,14)
InChIKeyQGDNIUHJZGHEDX-UHFFFAOYSA-N
XLogP0.83
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-[(3-methylphenyl)methyl]acetamide
CID 63679307
2-fluoro-N-[(3-methylphenyl)methyl]acetamide
CID 130011767
3-[[[2-(methylamino)acetyl]amino]methyl]benzoic acid
CID 61162466
N-[(3-methylphenyl)methyl]-2-(prop-2-ynylamino)acetamide
CID 79287743
ethyl N-[2-[(3-methylphenyl)methylamino]-2-oxoethyl]carbamate
CID 112992182
N-[(3-methylphenyl)methyl]-2-(2,4,6-trimethylanilino)acetamide
CID 108996939
tert-butyl N-[[3-[[[2-(methylamino)acetyl]amino]methyl]phenyl]methyl]carbamate
CID 174196710
2-(cyclopropylmethylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 60915187
3-chloro-N-[(3-methylphenyl)methyl]propanamide
CID 60913115
2-(3-methylphenyl)-N-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]acetamide
CID 112992263
2-(methylamino)-N-[(3-nitrophenyl)methyl]acetamide
CID 62504721
N-[(3-methylphenyl)methyl]-2-(propylsulfonylamino)acetamide
CID 112992190

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide?
The IUPAC name of 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide (CID 60913954) is 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide is CNCC(=O)NCc1cccc(C)c1.
What is the InChIKey of 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide?
The InChIKey is QGDNIUHJZGHEDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-9-4-3-5-10(6-9)7-13-11(14)8-12-2/h3-6,12H,7-8H2,1-2H3,(H,13,14).
What are the key properties of 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide?
2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide has a molecular weight of 192.26 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide is sourced from PubChem (CID 60913954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).