N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide

C21H17N3O2 — CID 30851445

IUPACN-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide
SMILESCc1ccc2c(NC(=O)C(c3ccccc3)c3ccccc3)noc2n1
InChIInChI=1S/C21H17N3O2/c1-14-12-13-17-19(24-26-21(17)22-14)23-20(25)18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,18H,1H3,(H,23,24,25)
InChIKeyBZCVUDDXUSLEAI-UHFFFAOYSA-N
MW343.39 g/mol
LogP4.30
Rot. Bonds4

About N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide

N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide (PubChem CID 30851445) has the molecular formula C21H17N3O2 and a molecular weight of 343.39 g/mol. Its IUPAC name is N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide
PubChem CID30851445
Molecular FormulaC21H17N3O2
Molecular Weight343.39 g/mol
Exact Mass343.13
IUPAC NameN-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide
SMILESCc1ccc2c(NC(=O)C(c3ccccc3)c3ccccc3)noc2n1
InChIInChI=1S/C21H17N3O2/c1-14-12-13-17-19(24-26-21(17)22-14)23-20(25)18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,18H,1H3,(H,23,24,25)
InChIKeyBZCVUDDXUSLEAI-UHFFFAOYSA-N
XLogP4.30
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide?
The IUPAC name of N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide (CID 30851445) is N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide.
What is the SMILES notation for N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide?
The canonical SMILES for N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide is Cc1ccc2c(NC(=O)C(c3ccccc3)c3ccccc3)noc2n1.
What is the InChIKey of N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide?
The InChIKey is BZCVUDDXUSLEAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2/c1-14-12-13-17-19(24-26-21(17)22-14)23-20(25)18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,18H,1H3,(H,23,24,25).
What are the key properties of N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide?
N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide has a molecular weight of 343.39 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-yl)-2,2-diphenylacetamide is sourced from PubChem (CID 30851445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).