N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide

C15H15ClN4O3 — CID 146142178

IUPACN-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide
SMILESCc1cc(COCC(=O)Nc2nc3cc(Cl)ccc3n2C)no1
InChIInChI=1S/C15H15ClN4O3/c1-9-5-11(19-23-9)7-22-8-14(21)18-15-17-12-6-10(16)3-4-13(12)20(15)2/h3-6H,7-8H2,1-2H3,(H,17,18,21)
InChIKeySPNJNCWCWWWBQG-UHFFFAOYSA-N
MW334.76 g/mol
LogP2.68
Rot. Bonds5

About N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide

N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide (PubChem CID 146142178) has the molecular formula C15H15ClN4O3 and a molecular weight of 334.76 g/mol. Its IUPAC name is N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide
PubChem CID146142178
Molecular FormulaC15H15ClN4O3
Molecular Weight334.76 g/mol
Exact Mass334.08
IUPAC NameN-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide
SMILESCc1cc(COCC(=O)Nc2nc3cc(Cl)ccc3n2C)no1
InChIInChI=1S/C15H15ClN4O3/c1-9-5-11(19-23-9)7-22-8-14(21)18-15-17-12-6-10(16)3-4-13(12)20(15)2/h3-6H,7-8H2,1-2H3,(H,17,18,21)
InChIKeySPNJNCWCWWWBQG-UHFFFAOYSA-N
XLogP2.68
TPSA82.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.76
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide?
The IUPAC name of N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide (CID 146142178) is N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide.
What is the SMILES notation for N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide?
The canonical SMILES for N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide is Cc1cc(COCC(=O)Nc2nc3cc(Cl)ccc3n2C)no1.
What is the InChIKey of N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide?
The InChIKey is SPNJNCWCWWWBQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN4O3/c1-9-5-11(19-23-9)7-22-8-14(21)18-15-17-12-6-10(16)3-4-13(12)20(15)2/h3-6H,7-8H2,1-2H3,(H,17,18,21).
What are the key properties of N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide?
N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide has a molecular weight of 334.76 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-1-methylbenzimidazol-2-yl)-2-[(5-methyl-1,2-oxazol-3-yl)methoxy]acetamide is sourced from PubChem (CID 146142178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).