2-[(2-amino-2-oxoethyl)-methylamino]benzamide

C10H13N3O2 — CID 68633336

IUPAC2-[(2-amino-2-oxoethyl)-methylamino]benzamide
SMILESCN(CC(N)=O)c1ccccc1C(N)=O
InChIInChI=1S/C10H13N3O2/c1-13(6-9(11)14)8-5-3-2-4-7(8)10(12)15/h2-5H,6H2,1H3,(H2,11,14)(H2,12,15)
InChIKeyNMBWGXYTOQYGML-UHFFFAOYSA-N
MW207.23 g/mol
LogP-0.29
Rot. Bonds4

About 2-[(2-amino-2-oxoethyl)-methylamino]benzamide

2-[(2-amino-2-oxoethyl)-methylamino]benzamide (PubChem CID 68633336) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethyl)-methylamino]benzamide.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethyl)-methylamino]benzamide
PubChem CID68633336
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name2-[(2-amino-2-oxoethyl)-methylamino]benzamide
SMILESCN(CC(N)=O)c1ccccc1C(N)=O
InChIInChI=1S/C10H13N3O2/c1-13(6-9(11)14)8-5-3-2-4-7(8)10(12)15/h2-5H,6H2,1H3,(H2,11,14)(H2,12,15)
InChIKeyNMBWGXYTOQYGML-UHFFFAOYSA-N
XLogP-0.29
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-(2-carbamothioyl-N-methylanilino)acetate
CID 28602163
4-[(2-carbamoyl-N-methylanilino)methyl]benzoic acid
CID 60979283
2-(2-carbamothioyl-4-fluoro-N-methylanilino)acetamide
CID 63672665
2-[2-(4-fluorophenyl)-N-methylanilino]acetamide
CID 54226152
methyl 2-[methyl(2-oxopropyl)amino]benzoate
CID 117029506
ethyl N-(2-carbamoylphenyl)-N-methylcarbamate
CID 174425529
2-amino-3-[[2-(diethylamino)-2-oxoethyl]-methylamino]benzamide
CID 115545191
2-[(4-carbamothioyl-3-pyridinyl)-methylamino]acetamide
CID 114288187
2-amino-3-[benzyl(methyl)amino]benzamide
CID 115544396
2-amino-3-[2-(dimethylamino)ethyl-methylamino]benzamide
CID 115546160
2-(2-amino-N-methyl-3-propan-2-yloxyanilino)acetamide
CID 113393311
benzene-1,2-dicarboxamide;hydrazine
CID 158131121

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethyl)-methylamino]benzamide?
The IUPAC name of 2-[(2-amino-2-oxoethyl)-methylamino]benzamide (CID 68633336) is 2-[(2-amino-2-oxoethyl)-methylamino]benzamide.
What is the SMILES notation for 2-[(2-amino-2-oxoethyl)-methylamino]benzamide?
The canonical SMILES for 2-[(2-amino-2-oxoethyl)-methylamino]benzamide is CN(CC(N)=O)c1ccccc1C(N)=O.
What is the InChIKey of 2-[(2-amino-2-oxoethyl)-methylamino]benzamide?
The InChIKey is NMBWGXYTOQYGML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-13(6-9(11)14)8-5-3-2-4-7(8)10(12)15/h2-5H,6H2,1H3,(H2,11,14)(H2,12,15).
What are the key properties of 2-[(2-amino-2-oxoethyl)-methylamino]benzamide?
2-[(2-amino-2-oxoethyl)-methylamino]benzamide has a molecular weight of 207.23 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethyl)-methylamino]benzamide is sourced from PubChem (CID 68633336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).