2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide

C11H14N4O — CID 116961662

IUPAC2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide
SMILESCNC(C(N)=O)c1ccc2nc(C)[nH]c2c1
InChIInChI=1S/C11H14N4O/c1-6-14-8-4-3-7(5-9(8)15-6)10(13-2)11(12)16/h3-5,10,13H,1-2H3,(H2,12,16)(H,14,15)
InChIKeyXFSBEVNGZKGMBL-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.62
Rot. Bonds3

About 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide

2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide (PubChem CID 116961662) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide
PubChem CID116961662
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide
SMILESCNC(C(N)=O)c1ccc2nc(C)[nH]c2c1
InChIInChI=1S/C11H14N4O/c1-6-14-8-4-3-7(5-9(8)15-6)10(13-2)11(12)16/h3-5,10,13H,1-2H3,(H2,12,16)(H,14,15)
InChIKeyXFSBEVNGZKGMBL-UHFFFAOYSA-N
XLogP0.62
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide 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

methylamino-(2-methyl-3H-benzimidazol-5-yl)methanol
CID 116954709
2-(dimethylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide
CID 116914786
3-amino-N-methyl-3-(2-methyl-3H-benzimidazol-5-yl)propanamide
CID 116850693
3-amino-N'-methyl-3-(2-methyl-3H-benzimidazol-5-yl)propanehydrazide
CID 116849707
methyl 2-(dimethylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetate
CID 116857134
1-methoxy-N-methyl-1-(2-methyl-3H-benzimidazol-5-yl)methanamine
CID 116961533
ethyl 2-hydroxy-2-(2-methyl-3H-benzimidazol-5-yl)acetate
CID 117340177
2-methyl-6-propan-2-yl-1H-benzimidazole
CID 21069154
hydrazinyl-(2-methyl-3H-benzimidazol-5-yl)methanamine
CID 116947494
2-(methylamino)-1-(2-methyl-3H-benzimidazol-5-yl)propan-1-one
CID 82493358
4-[amino-(2-methyl-3H-benzimidazol-5-yl)methyl]-N-methylaniline
CID 116936897
4-(dimethylamino)-4-(2-methyl-3H-benzimidazol-5-yl)butan-2-one
CID 116910560

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide?
The IUPAC name of 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide (CID 116961662) is 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide.
What is the SMILES notation for 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide?
The canonical SMILES for 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide is CNC(C(N)=O)c1ccc2nc(C)[nH]c2c1.
What is the InChIKey of 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide?
The InChIKey is XFSBEVNGZKGMBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-6-14-8-4-3-7(5-9(8)15-6)10(13-2)11(12)16/h3-5,10,13H,1-2H3,(H2,12,16)(H,14,15).
What are the key properties of 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide?
2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide has a molecular weight of 218.26 g/mol, XLogP of 0.62, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-2-(2-methyl-3H-benzimidazol-5-yl)acetamide is sourced from PubChem (CID 116961662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).