N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide

C17H18N4OS — CID 651621

IUPACN-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(-c2cncs2)nc2ccccc21)NC1CCCC1
InChIInChI=1S/C17H18N4OS/c22-16(19-12-5-1-2-6-12)10-21-14-8-4-3-7-13(14)20-17(21)15-9-18-11-23-15/h3-4,7-9,11-12H,1-2,5-6,10H2,(H,19,22)
InChIKeyUITQMRRHNIWMJP-UHFFFAOYSA-N
MW326.42 g/mol
LogP3.22
Rot. Bonds4

About N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide

N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide (PubChem CID 651621) has the molecular formula C17H18N4OS and a molecular weight of 326.42 g/mol. Its IUPAC name is N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide
PubChem CID651621
Molecular FormulaC17H18N4OS
Molecular Weight326.42 g/mol
Exact Mass326.12
IUPAC NameN-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(-c2cncs2)nc2ccccc21)NC1CCCC1
InChIInChI=1S/C17H18N4OS/c22-16(19-12-5-1-2-6-12)10-21-14-8-4-3-7-13(14)20-17(21)15-9-18-11-23-15/h3-4,7-9,11-12H,1-2,5-6,10H2,(H,19,22)
InChIKeyUITQMRRHNIWMJP-UHFFFAOYSA-N
XLogP3.22
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide (CID 651621) is N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide is O=C(Cn1c(-c2cncs2)nc2ccccc21)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide?
The InChIKey is UITQMRRHNIWMJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4OS/c22-16(19-12-5-1-2-6-12)10-21-14-8-4-3-7-13(14)20-17(21)15-9-18-11-23-15/h3-4,7-9,11-12H,1-2,5-6,10H2,(H,19,22).
What are the key properties of N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide?
N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide has a molecular weight of 326.42 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 651621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).