2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide

C14H14N4O2 — CID 110772690

IUPAC2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1nc2ccc(CC(=O)Nc3cc(C)on3)cc2[nH]1
InChIInChI=1S/C14H14N4O2/c1-8-5-13(18-20-8)17-14(19)7-10-3-4-11-12(6-10)16-9(2)15-11/h3-6H,7H2,1-2H3,(H,15,16)(H,17,18,19)
InChIKeyKUZIZSNIJRQCKA-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.35
Rot. Bonds3

About 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide

2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 110772690) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID110772690
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Name2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1nc2ccc(CC(=O)Nc3cc(C)on3)cc2[nH]1
InChIInChI=1S/C14H14N4O2/c1-8-5-13(18-20-8)17-14(19)7-10-3-4-11-12(6-10)16-9(2)15-11/h3-6H,7H2,1-2H3,(H,15,16)(H,17,18,19)
InChIKeyKUZIZSNIJRQCKA-UHFFFAOYSA-N
XLogP2.35
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 110772690) is 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1nc2ccc(CC(=O)Nc3cc(C)on3)cc2[nH]1.
What is the InChIKey of 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is KUZIZSNIJRQCKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c1-8-5-13(18-20-8)17-14(19)7-10-3-4-11-12(6-10)16-9(2)15-11/h3-6H,7H2,1-2H3,(H,15,16)(H,17,18,19).
What are the key properties of 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 270.29 g/mol, XLogP of 2.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-3H-benzimidazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 110772690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).