6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one

C16H13N3O2 — CID 3584203

IUPAC6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one
SMILESCc1ccc2nc(-c3ccc4c(c3)NC(=O)CO4)cn2c1
InChIInChI=1S/C16H13N3O2/c1-10-2-5-15-17-13(8-19(15)7-10)11-3-4-14-12(6-11)18-16(20)9-21-14/h2-8H,9H2,1H3,(H,18,20)
InChIKeyRUIVPKHWWWKTPM-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.64
Rot. Bonds1

About 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one

6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one (PubChem CID 3584203) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one.

Molecular Properties

Compound Name6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one
PubChem CID3584203
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one
SMILESCc1ccc2nc(-c3ccc4c(c3)NC(=O)CO4)cn2c1
InChIInChI=1S/C16H13N3O2/c1-10-2-5-15-17-13(8-19(15)7-10)11-3-4-14-12(6-11)18-16(20)9-21-14/h2-8H,9H2,1H3,(H,18,20)
InChIKeyRUIVPKHWWWKTPM-UHFFFAOYSA-N
XLogP2.64
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one?
The IUPAC name of 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one (CID 3584203) is 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one.
What is the SMILES notation for 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one?
The canonical SMILES for 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one is Cc1ccc2nc(-c3ccc4c(c3)NC(=O)CO4)cn2c1.
What is the InChIKey of 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one?
The InChIKey is RUIVPKHWWWKTPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-10-2-5-15-17-13(8-19(15)7-10)11-3-4-14-12(6-11)18-16(20)9-21-14/h2-8H,9H2,1H3,(H,18,20).
What are the key properties of 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one?
6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one has a molecular weight of 279.30 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-methylimidazo[1,2-a]pyridin-2-yl)-4H-1,4-benzoxazin-3-one is sourced from PubChem (CID 3584203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).