8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one

C18H16ClN3O3 — CID 134808903

IUPAC8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(Nc3cccc(Cl)c3)nccc12
InChIInChI=1S/C18H16ClN3O3/c19-12-2-1-3-13(10-12)21-18-17-14(4-5-20-18)15(23)11-16(25-17)22-6-8-24-9-7-22/h1-5,10-11H,6-9H2,(H,20,21)
InChIKeySHEOEOXSSZFTHR-UHFFFAOYSA-N
MW357.80 g/mol
LogP3.42
Rot. Bonds3

About 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one

8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one (PubChem CID 134808903) has the molecular formula C18H16ClN3O3 and a molecular weight of 357.80 g/mol. Its IUPAC name is 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one.

Molecular Properties

Compound Name8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one
PubChem CID134808903
Molecular FormulaC18H16ClN3O3
Molecular Weight357.80 g/mol
Exact Mass357.09
IUPAC Name8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(Nc3cccc(Cl)c3)nccc12
InChIInChI=1S/C18H16ClN3O3/c19-12-2-1-3-13(10-12)21-18-17-14(4-5-20-18)15(23)11-16(25-17)22-6-8-24-9-7-22/h1-5,10-11H,6-9H2,(H,20,21)
InChIKeySHEOEOXSSZFTHR-UHFFFAOYSA-N
XLogP3.42
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.80
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-[(3,5-dimethoxyphenyl)methylamino]-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one
CID 134809845
8-methyl-2-morpholin-4-ylchromen-4-one
CID 10083230
8-(6-chlorodibenzothiophen-4-yl)-2-morpholin-4-ylchromen-4-one
CID 54757263
2-morpholin-4-yl-8-phenylchromen-4-one
CID 3973
8-(2-methylphenyl)-2-morpholin-4-ylchromen-4-one
CID 23586698
8-(4-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one
CID 11652716
8-(3-hydroxyphenyl)-2-morpholin-4-ylchromen-4-one
CID 11609490
8-(4-fluoro-2-methoxyphenyl)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one
CID 134810395
2-(1,4-oxazepan-4-yl)benzo[h]chromen-4-one
CID 11208656
N-(3-chlorophenyl)-2-methyl-6-morpholin-4-ylpyrimidin-4-amine
CID 112869918
8-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-morpholin-4-ylchromen-4-one
CID 166450920
8-methyl-2-morpholin-4-yl-7-phenylchromen-4-one
CID 21460270

Frequently Asked Questions

What is the IUPAC name of 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one?
The IUPAC name of 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one (CID 134808903) is 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one.
What is the SMILES notation for 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one?
The canonical SMILES for 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one is O=c1cc(N2CCOCC2)oc2c(Nc3cccc(Cl)c3)nccc12.
What is the InChIKey of 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one?
The InChIKey is SHEOEOXSSZFTHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN3O3/c19-12-2-1-3-13(10-12)21-18-17-14(4-5-20-18)15(23)11-16(25-17)22-6-8-24-9-7-22/h1-5,10-11H,6-9H2,(H,20,21).
What are the key properties of 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one?
8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one has a molecular weight of 357.80 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-chloroanilino)-2-morpholin-4-ylpyrano[2,3-c]pyridin-4-one is sourced from PubChem (CID 134808903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).