2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one

C42H37N5O7 — CID 178026591

IUPAC2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one
SMILESO=c1cc(-c2cccnc2)oc2c(-c3ccccc3Oc3ccccc3)nccc12.O=c1cc(N2CCOCC2)oc2c(NC3CCOCC3)nccc12
InChIInChI=1S/C25H16N2O3.C17H21N3O4/c28-21-15-23(17-7-6-13-26-16-17)30-25-19(21)12-14-27-24(25)20-10-4-5-11-22(20)29-18-8-2-1-3-9-18;21-14-11-15(20-5-9-23-10-6-20)24-16-13(14)1-4-18-17(16)19-12-2-7-22-8-3-12/h1-16H;1,4,11-12H,2-3,5-10H2,(H,18,19)
InChIKeyAHRYJDFOKGHRPW-UHFFFAOYSA-N
MW723.79 g/mol
LogP7.32
Rot. Bonds7

About 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one

2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one (PubChem CID 178026591) has the molecular formula C42H37N5O7 and a molecular weight of 723.79 g/mol. Its IUPAC name is 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one.

Molecular Properties

Compound Name2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one
PubChem CID178026591
Molecular FormulaC42H37N5O7
Molecular Weight723.79 g/mol
Exact Mass723.27
IUPAC Name2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one
SMILESO=c1cc(-c2cccnc2)oc2c(-c3ccccc3Oc3ccccc3)nccc12.O=c1cc(N2CCOCC2)oc2c(NC3CCOCC3)nccc12
InChIInChI=1S/C25H16N2O3.C17H21N3O4/c28-21-15-23(17-7-6-13-26-16-17)30-25-19(21)12-14-27-24(25)20-10-4-5-11-22(20)29-18-8-2-1-3-9-18;21-14-11-15(20-5-9-23-10-6-20)24-16-13(14)1-4-18-17(16)19-12-2-7-22-8-3-12/h1-16H;1,4,11-12H,2-3,5-10H2,(H,18,19)
InChIKeyAHRYJDFOKGHRPW-UHFFFAOYSA-N
XLogP7.32
TPSA142.05 Ų
H-Bond Donors1
H-Bond Acceptors12
Rotatable Bonds7
Heavy Atoms54
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500723.79
LogP ≤ 57.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1012

Analyze 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one with MolForge

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Launch Full Analysis

Related Compounds

8-(4-fluoro-2-methoxyphenyl)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one
CID 134810395
2-morpholin-4-yl-8-phenylchromen-4-one
CID 3973
8-[(3,5-dimethoxyphenyl)methylamino]-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one
CID 134809845
8-methyl-2-morpholin-4-yl-7-phenylchromen-4-one
CID 21460270
8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one
CID 134808903
2-methyl-5-(3-morpholin-4-ylphenyl)-6-(2-phenoxyphenyl)pyridazin-3-one
CID 140623630
8-methyl-2-morpholin-4-yl-7-(pyridin-3-ylmethoxy)chromen-4-one
CID 15650862
8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one
CID 11609490
2-morpholin-4-yl-8-(4-phenylmethoxyphenyl)chromen-4-one
CID 11697295
methyl 2-[4-(2-morpholin-4-yl-4-oxochromen-8-yl)-2-phenylphenoxy]acetate
CID 58757664
2-(8-methyl-2-morpholin-4-yl-4-oxochromen-7-yl)oxy-N-pyridin-3-ylacetamide
CID 21460070
2-[4-(2-morpholin-4-yl-4-oxochromen-8-yl)-2-phenylphenoxy]-N-(oxolan-2-ylmethyl)acetamide
CID 11956211

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one?
The IUPAC name of 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one (CID 178026591) is 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one.
What is the SMILES notation for 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one?
The canonical SMILES for 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one is O=c1cc(-c2cccnc2)oc2c(-c3ccccc3Oc3ccccc3)nccc12.O=c1cc(N2CCOCC2)oc2c(NC3CCOCC3)nccc12.
What is the InChIKey of 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one?
The InChIKey is AHRYJDFOKGHRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16N2O3.C17H21N3O4/c28-21-15-23(17-7-6-13-26-16-17)30-25-19(21)12-14-27-24(25)20-10-4-5-11-22(20)29-18-8-2-1-3-9-18;21-14-11-15(20-5-9-23-10-6-20)24-16-13(14)1-4-18-17(16)19-12-2-7-22-8-3-12/h1-16H;1,4,11-12H,2-3,5-10H2,(H,18,19).
What are the key properties of 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one?
2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one has a molecular weight of 723.79 g/mol, XLogP of 7.32, 7 rotatable bonds, 1 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-8-(oxan-4-ylamino)pyrano[2,3-c]pyridin-4-one;8-(2-phenoxyphenyl)-2-pyridin-3-ylpyrano[2,3-c]pyridin-4-one is sourced from PubChem (CID 178026591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).