N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide

C24H23N3OS — CID 53383175

IUPACN-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide
SMILESO=C(NC1CCCC1)C(c1ccccc1)n1c(-c2cccs2)nc2ccccc21
InChIInChI=1S/C24H23N3OS/c28-24(25-18-11-4-5-12-18)22(17-9-2-1-3-10-17)27-20-14-7-6-13-19(20)26-23(27)21-15-8-16-29-21/h1-3,6-10,13-16,18,22H,4-5,11-12H2,(H,25,28)
InChIKeyACOLWRWSVMVYAU-UHFFFAOYSA-N
MW401.54 g/mol
LogP5.41
Rot. Bonds5

About N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide

N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide (PubChem CID 53383175) has the molecular formula C24H23N3OS and a molecular weight of 401.54 g/mol. Its IUPAC name is N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide
PubChem CID53383175
Molecular FormulaC24H23N3OS
Molecular Weight401.54 g/mol
Exact Mass401.16
IUPAC NameN-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide
SMILESO=C(NC1CCCC1)C(c1ccccc1)n1c(-c2cccs2)nc2ccccc21
InChIInChI=1S/C24H23N3OS/c28-24(25-18-11-4-5-12-18)22(17-9-2-1-3-10-17)27-20-14-7-6-13-19(20)26-23(27)21-15-8-16-29-21/h1-3,6-10,13-16,18,22H,4-5,11-12H2,(H,25,28)
InChIKeyACOLWRWSVMVYAU-UHFFFAOYSA-N
XLogP5.41
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.54
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide (CID 53383175) is N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide is O=C(NC1CCCC1)C(c1ccccc1)n1c(-c2cccs2)nc2ccccc21.
What is the InChIKey of N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide?
The InChIKey is ACOLWRWSVMVYAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3OS/c28-24(25-18-11-4-5-12-18)22(17-9-2-1-3-10-17)27-20-14-7-6-13-19(20)26-23(27)21-15-8-16-29-21/h1-3,6-10,13-16,18,22H,4-5,11-12H2,(H,25,28).
What are the key properties of N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide?
N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide has a molecular weight of 401.54 g/mol, XLogP of 5.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-phenyl-2-(2-thiophen-2-ylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 53383175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).