5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine

C11H10N4O — CID 116832297

IUPAC5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine
SMILESCn1cnc2cc(-c3cnc(N)o3)ccc21
InChIInChI=1S/C11H10N4O/c1-15-6-14-8-4-7(2-3-9(8)15)10-5-13-11(12)16-10/h2-6H,1H3,(H2,12,13)
InChIKeyPWRWQZZOZRARBS-UHFFFAOYSA-N
MW214.23 g/mol
LogP1.81
Rot. Bonds1

About 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine

5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine (PubChem CID 116832297) has the molecular formula C11H10N4O and a molecular weight of 214.23 g/mol. Its IUPAC name is 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine
PubChem CID116832297
Molecular FormulaC11H10N4O
Molecular Weight214.23 g/mol
Exact Mass214.09
IUPAC Name5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine
SMILESCn1cnc2cc(-c3cnc(N)o3)ccc21
InChIInChI=1S/C11H10N4O/c1-15-6-14-8-4-7(2-3-9(8)15)10-5-13-11(12)16-10/h2-6H,1H3,(H2,12,13)
InChIKeyPWRWQZZOZRARBS-UHFFFAOYSA-N
XLogP1.81
TPSA69.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-1-[(2R)-2-(dimethylamino)-2-phenyl-acetyl]-N-[4-[5-[2-[(2S)-1-[(2R)-2-(dimethylamino)-2-phenyl-acetyl]pyrrolidin-2-yl]-1H-benzimidazol-5-yl]oxazol-2-yl]phenyl]pyrrolidine-2-carboxamide
CID 46893268
(2S)-1-[(2R)-2-(dimethylamino)-2-phenyl-acetyl]-N-[3-[5-[2-[(2S)-1-[(2R)-2-(dimethylamino)-2-phenyl-acetyl]pyrrolidin-2-yl]-1H-benzimidazol-5-yl]oxazol-2-yl]phenyl]pyrrolidine-2-carboxamide
CID 58384795
2-(1H-Benzoimidazol-5-yl)-benzooxazole
CID 831980
N-(2',4'-difluoro-5-(5-(oxazol-5-yl)-1H-benzo[d]imidazol-1-yl)biphenyl-3-yl)acetamide
CID 71554148
N-[3-(2,4-difluorophenyl)-5-[5-(1,3-oxazol-5-yl)benzimidazol-1-yl]phenyl]propane-2-sulfonamide
CID 89501248
US10035777, Example 31
CID 118864375
US10035777, Example 104
CID 118880563
US10035777, Example 105
CID 118880578
US10035777, Example 36
CID 118880633
N-[5-[[[(2S)-3,3-dimethylbutan-2-yl]amino]methyl]-1-(6-prop-2-enoyl-6-azaspiro[3.4]octan-2-yl)benzimidazol-2-yl]-3-(1,3-oxazol-5-yl)benzamide
CID 134277752
N-[5-[[[(2S)-3,3-dimethylbutan-2-yl]amino]methyl]-1-(6-prop-2-enoyl-6-azaspiro[3.4]octan-2-yl)benzimidazol-2-yl]-4-(1,3-oxazol-5-yl)benzamide
CID 139440937
5-Fluoro-2-(1-methylbenzimidazol-5-yl)-[1,3]oxazolo[5,4-b]pyridine
CID 71455716

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine?
The IUPAC name of 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine (CID 116832297) is 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine.
What is the SMILES notation for 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine?
The canonical SMILES for 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine is Cn1cnc2cc(-c3cnc(N)o3)ccc21.
What is the InChIKey of 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine?
The InChIKey is PWRWQZZOZRARBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O/c1-15-6-14-8-4-7(2-3-9(8)15)10-5-13-11(12)16-10/h2-6H,1H3,(H2,12,13).
What are the key properties of 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine?
5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine has a molecular weight of 214.23 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylbenzimidazol-5-yl)-1,3-oxazol-2-amine is sourced from PubChem (CID 116832297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).