N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide

C19H21N3O — CID 110772768

IUPACN-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide
SMILESCCc1nc2ccc(CC(=O)N(CC)c3ccccc3)cc2[nH]1
InChIInChI=1S/C19H21N3O/c1-3-18-20-16-11-10-14(12-17(16)21-18)13-19(23)22(4-2)15-8-6-5-7-9-15/h5-12H,3-4,13H2,1-2H3,(H,20,21)
InChIKeyGRIBKWMBIYHSIR-UHFFFAOYSA-N
MW307.40 g/mol
LogP3.72
Rot. Bonds5

About N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide

N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide (PubChem CID 110772768) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide.

Molecular Properties

Compound NameN-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide
PubChem CID110772768
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC NameN-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide
SMILESCCc1nc2ccc(CC(=O)N(CC)c3ccccc3)cc2[nH]1
InChIInChI=1S/C19H21N3O/c1-3-18-20-16-11-10-14(12-17(16)21-18)13-19(23)22(4-2)15-8-6-5-7-9-15/h5-12H,3-4,13H2,1-2H3,(H,20,21)
InChIKeyGRIBKWMBIYHSIR-UHFFFAOYSA-N
XLogP3.72
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethyl-3H-benzimidazol-5-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 110772732
2-(2-ethyl-3H-benzimidazol-5-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 110772738
(2-ethyl-3H-benzimidazol-5-yl)methanesulfonic acid
CID 175304465
N-(3-acetylphenyl)-2-(2-ethyl-3H-benzimidazol-5-yl)acetamide
CID 110772781
2-(3-bromophenyl)-N-ethyl-N-phenylacetamide
CID 113098483
1-(2-ethyl-3H-benzimidazol-5-yl)-2-methylpropan-1-one
CID 82493033
N-(2-ethyl-3H-benzimidazol-5-yl)-N-methyl-2-(methylamino)acetamide
CID 82498230
1-(2-ethyl-3H-benzimidazol-5-yl)propan-1-one
CID 39104518
3-(6-ethyl-1H-benzimidazol-2-yl)propanoic acid
CID 79017254
N-(4-cyanophenyl)-2-(2-ethyl-3H-benzimidazol-5-yl)acetamide
CID 110772803
2-ethyl-N-[(4-methylphenyl)methyl]-3H-benzimidazole-5-carboxamide
CID 110765518
tert-butyl N-[(2-ethyl-3H-benzimidazol-5-yl)methyl]carbamate
CID 142258214

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide?
The IUPAC name of N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide (CID 110772768) is N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide.
What is the SMILES notation for N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide?
The canonical SMILES for N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide is CCc1nc2ccc(CC(=O)N(CC)c3ccccc3)cc2[nH]1.
What is the InChIKey of N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide?
The InChIKey is GRIBKWMBIYHSIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O/c1-3-18-20-16-11-10-14(12-17(16)21-18)13-19(23)22(4-2)15-8-6-5-7-9-15/h5-12H,3-4,13H2,1-2H3,(H,20,21).
What are the key properties of N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide?
N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide has a molecular weight of 307.40 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide is sourced from PubChem (CID 110772768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).