2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide

C23H24Cl2N4O2 — CID 71886350

IUPAC2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide
SMILESCC(NC(=O)Cn1c(-c2cccc(Cl)c2Cl)nc2ccccc21)C(=O)N1CCCCC1
InChIInChI=1S/C23H24Cl2N4O2/c1-15(23(31)28-12-5-2-6-13-28)26-20(30)14-29-19-11-4-3-10-18(19)27-22(29)16-8-7-9-17(24)21(16)25/h3-4,7-11,15H,2,5-6,12-14H2,1H3,(H,26,30)
InChIKeyCCOBFSCZTOQSSP-UHFFFAOYSA-N
MW459.38 g/mol
LogP4.53
Rot. Bonds5

About 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide

2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide (PubChem CID 71886350) has the molecular formula C23H24Cl2N4O2 and a molecular weight of 459.38 g/mol. Its IUPAC name is 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide
PubChem CID71886350
Molecular FormulaC23H24Cl2N4O2
Molecular Weight459.38 g/mol
Exact Mass458.13
IUPAC Name2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide
SMILESCC(NC(=O)Cn1c(-c2cccc(Cl)c2Cl)nc2ccccc21)C(=O)N1CCCCC1
InChIInChI=1S/C23H24Cl2N4O2/c1-15(23(31)28-12-5-2-6-13-28)26-20(30)14-29-19-11-4-3-10-18(19)27-22(29)16-8-7-9-17(24)21(16)25/h3-4,7-11,15H,2,5-6,12-14H2,1H3,(H,26,30)
InChIKeyCCOBFSCZTOQSSP-UHFFFAOYSA-N
XLogP4.53
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500459.38
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-ethoxyacetamide
CID 86808879
N-tert-butyl-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide
CID 17032773
2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide
CID 17032674
N-(4-tert-butylphenyl)-2-[2-(2-chlorophenyl)benzimidazol-1-yl]acetamide
CID 5252722
2-[2-(2,4-dimethylphenyl)benzimidazol-1-yl]-1-piperidin-1-ylethanone
CID 16987650
N-[1-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]benzamide
CID 16967444
(2R)-2-[[2-methyl-6-[(2-methylbenzimidazol-1-yl)methyl]pyrimidin-4-yl]amino]-1-piperidin-1-ylpropan-1-one
CID 92612508
2-[2-(1-chloroethyl)benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 43667741
2-(4-chlorophenyl)-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]acetamide
CID 94667978
2-[2-[(2-chlorophenoxy)methyl]benzimidazol-1-yl]-N-propan-2-ylacetamide
CID 17031857
2-[1-[2-(hydroxyamino)-2-oxoethyl]benzimidazol-2-yl]benzoic acid
CID 155737900
N-[[1-(2-oxo-2-piperidin-1-ylethyl)benzimidazol-2-yl]methyl]acetamide
CID 17006020

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide?
The IUPAC name of 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide (CID 71886350) is 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide.
What is the SMILES notation for 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide?
The canonical SMILES for 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide is CC(NC(=O)Cn1c(-c2cccc(Cl)c2Cl)nc2ccccc21)C(=O)N1CCCCC1.
What is the InChIKey of 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide?
The InChIKey is CCOBFSCZTOQSSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24Cl2N4O2/c1-15(23(31)28-12-5-2-6-13-28)26-20(30)14-29-19-11-4-3-10-18(19)27-22(29)16-8-7-9-17(24)21(16)25/h3-4,7-11,15H,2,5-6,12-14H2,1H3,(H,26,30).
What are the key properties of 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide?
2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide has a molecular weight of 459.38 g/mol, XLogP of 4.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,3-dichlorophenyl)benzimidazol-1-yl]-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide is sourced from PubChem (CID 71886350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).