2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide

C18H20N4O — CID 93215396

IUPAC2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cn2c(C)nc3c(N)cccc32)c(C)c1
InChIInChI=1S/C18H20N4O/c1-11-7-8-15(12(2)9-11)21-17(23)10-22-13(3)20-18-14(19)5-4-6-16(18)22/h4-9H,10,19H2,1-3H3,(H,21,23)
InChIKeyDZLHOMFODJUZSN-UHFFFAOYSA-N
MW308.39 g/mol
LogP3.18
Rot. Bonds3

About 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide

2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide (PubChem CID 93215396) has the molecular formula C18H20N4O and a molecular weight of 308.39 g/mol. Its IUPAC name is 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide
PubChem CID93215396
Molecular FormulaC18H20N4O
Molecular Weight308.39 g/mol
Exact Mass308.16
IUPAC Name2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cn2c(C)nc3c(N)cccc32)c(C)c1
InChIInChI=1S/C18H20N4O/c1-11-7-8-15(12(2)9-11)21-17(23)10-22-13(3)20-18-14(19)5-4-6-16(18)22/h4-9H,10,19H2,1-3H3,(H,21,23)
InChIKeyDZLHOMFODJUZSN-UHFFFAOYSA-N
XLogP3.18
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-amino-2-methylbenzimidazol-1-yl)-N-propylacetamide
CID 82067163
N-(2,4-dimethylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 1081528
2-(2,6-dimethyl-4-oxo-7H-pyrrolo[2,3-d]pyrimidin-3-yl)-N-(2,4-dimethylphenyl)acetamide
CID 110429923
N-(2,4-dimethylphenyl)-2-[2-[(E)-2-phenylethenyl]benzimidazol-1-yl]acetamide
CID 17031753
N-(2,4-dimethylphenyl)-2-(2-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide
CID 23409130
2-(benzotriazol-1-yl)-N-(2,4-dimethylphenyl)acetamide
CID 856334
N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide
CID 802610
2-(4-amino-2-methylbenzimidazol-1-yl)-N-ethyl-N-phenylacetamide
CID 93215409
3-amino-N-(2,4-dimethylphenyl)propanamide;hydrochloride
CID 50944164
2-amino-N-(2,4-dimethylphenyl)benzamide;hydrochloride
CID 170900117
2-[2-[(2-chlorophenoxy)methyl]benzimidazol-1-yl]-N-(2,4-dimethylphenyl)acetamide
CID 17031887
2-(2-methylbenzimidazol-1-yl)-N-(2-methyl-4-thiomorpholin-4-ylphenyl)acetamide
CID 49364541

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide?
The IUPAC name of 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide (CID 93215396) is 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide?
The canonical SMILES for 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide is Cc1ccc(NC(=O)Cn2c(C)nc3c(N)cccc32)c(C)c1.
What is the InChIKey of 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide?
The InChIKey is DZLHOMFODJUZSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c1-11-7-8-15(12(2)9-11)21-17(23)10-22-13(3)20-18-14(19)5-4-6-16(18)22/h4-9H,10,19H2,1-3H3,(H,21,23).
What are the key properties of 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide?
2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide has a molecular weight of 308.39 g/mol, XLogP of 3.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2-methylbenzimidazol-1-yl)-N-(2,4-dimethylphenyl)acetamide is sourced from PubChem (CID 93215396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).