7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one

C18H18N6O2 — CID 162674433

IUPAC7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one
SMILESCN1C(=O)COc2cc(Nc3ccc4ncn(CC5CC5)c4n3)cnc21
InChIInChI=1S/C18H18N6O2/c1-23-16(25)9-26-14-6-12(7-19-18(14)23)21-15-5-4-13-17(22-15)24(10-20-13)8-11-2-3-11/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,22)
InChIKeyZFGPYZHZJZECAZ-UHFFFAOYSA-N
MW350.38 g/mol
LogP2.34
Rot. Bonds4

About 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one

7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one (PubChem CID 162674433) has the molecular formula C18H18N6O2 and a molecular weight of 350.38 g/mol. Its IUPAC name is 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one.

Molecular Properties

Compound Name7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one
PubChem CID162674433
Molecular FormulaC18H18N6O2
Molecular Weight350.38 g/mol
Exact Mass350.15
IUPAC Name7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one
SMILESCN1C(=O)COc2cc(Nc3ccc4ncn(CC5CC5)c4n3)cnc21
InChIInChI=1S/C18H18N6O2/c1-23-16(25)9-26-14-6-12(7-19-18(14)23)21-15-5-4-13-17(22-15)24(10-20-13)8-11-2-3-11/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,22)
InChIKeyZFGPYZHZJZECAZ-UHFFFAOYSA-N
XLogP2.34
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one with MolForge

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Related Compounds

7-[[3-(cyclopropylmethyl)-6-fluoroimidazo[4,5-b]pyridin-5-yl]amino]-4-methyl-1,4-benzoxazin-3-one
CID 118278526
7-[[1-(cyclopropylmethyl)-4-methylimidazo[4,5-c]pyridin-6-yl]amino]-4-ethylpyrido[3,2-b][1,4]oxazin-3-one
CID 118278509
7-[[3-(cyclopropylmethyl)-6-hydroxybenzimidazol-5-yl]amino]-4-methyl-1,4-benzoxazin-3-one
CID 118278454
7-[[3-(cyclopropylmethyl)-6-fluorobenzimidazol-5-yl]amino]-4-methylpyrido[4,3-b][1,4]oxazin-3-one
CID 118278468
7-[[3-(2-cyclopropylethyl)-6-fluorobenzimidazol-5-yl]amino]-4-methyl-1,4-benzoxazin-3-one
CID 122688076
7-[[1-(cyclopropylmethyl)-4-methylimidazo[4,5-c]pyridin-6-yl]amino]-4-(2-methoxyethyl)-1,4-benzoxazin-3-one
CID 122688005
7-acetyl-4-methylpyrido[3,2-b][1,4]oxazin-3-one
CID 57258718
6-[[1-(cyclopropylmethyl)imidazo[4,5-c]pyridin-6-yl]amino]-1-methyl-3,4-dihydroquinazolin-2-one
CID 118278467
6-chloro-7-[[3-(cyclopropylmethyl)-7-methylimidazo[4,5-b]pyridin-5-yl]amino]-4-(2,2-difluoroethyl)-1,4-benzoxazin-3-one
CID 122688215
4-(cyclopropylmethyl)-6-[[5-fluoro-2-[3-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]pyrido[3,2-b][1,4]oxazin-3-one
CID 59405670
5,6-dichloro-3-(cyclopropylmethyl)imidazo[4,5-b]pyridine
CID 118288394
3-(cyclopropylmethyl)-N-(6-imidazol-1-yl-3-pyridinyl)-7-methylimidazo[4,5-b]pyridin-5-amine
CID 118278495

Frequently Asked Questions

What is the IUPAC name of 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one?
The IUPAC name of 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one (CID 162674433) is 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one.
What is the SMILES notation for 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one?
The canonical SMILES for 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one is CN1C(=O)COc2cc(Nc3ccc4ncn(CC5CC5)c4n3)cnc21.
What is the InChIKey of 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one?
The InChIKey is ZFGPYZHZJZECAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O2/c1-23-16(25)9-26-14-6-12(7-19-18(14)23)21-15-5-4-13-17(22-15)24(10-20-13)8-11-2-3-11/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,22).
What are the key properties of 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one?
7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one has a molecular weight of 350.38 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[[3-(cyclopropylmethyl)imidazo[4,5-b]pyridin-5-yl]amino]-4-methylpyrido[3,2-b][1,4]oxazin-3-one is sourced from PubChem (CID 162674433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).