2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide

C17H23N3O — CID 110773345

IUPAC2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)Cc1ccc2c(c1)nc(C1CC1)n2C
InChIInChI=1S/C17H23N3O/c1-11(2)10-18-16(21)9-12-4-7-15-14(8-12)19-17(20(15)3)13-5-6-13/h4,7-8,11,13H,5-6,9-10H2,1-3H3,(H,18,21)
InChIKeyQXWHGSMQYLJYBO-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.77
Rot. Bonds5

About 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide

2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide (PubChem CID 110773345) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide
PubChem CID110773345
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)Cc1ccc2c(c1)nc(C1CC1)n2C
InChIInChI=1S/C17H23N3O/c1-11(2)10-18-16(21)9-12-4-7-15-14(8-12)19-17(20(15)3)13-5-6-13/h4,7-8,11,13H,5-6,9-10H2,1-3H3,(H,18,21)
InChIKeyQXWHGSMQYLJYBO-UHFFFAOYSA-N
XLogP2.77
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide (CID 110773345) is 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide is CC(C)CNC(=O)Cc1ccc2c(c1)nc(C1CC1)n2C.
What is the InChIKey of 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide?
The InChIKey is QXWHGSMQYLJYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-11(2)10-18-16(21)9-12-4-7-15-14(8-12)19-17(20(15)3)13-5-6-13/h4,7-8,11,13H,5-6,9-10H2,1-3H3,(H,18,21).
What are the key properties of 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide?
2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide has a molecular weight of 285.39 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 110773345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).