6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one

C24H24N2O4 — CID 71705186

IUPAC6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one
SMILESCc1cc2oc(=O)cc(-c3cc4c(CN5CCOCC5)cnc(C)c4o3)c2cc1C
InChIInChI=1S/C24H24N2O4/c1-14-8-19-20(11-23(27)29-21(19)9-15(14)2)22-10-18-17(12-25-16(3)24(18)30-22)13-26-4-6-28-7-5-26/h8-12H,4-7,13H2,1-3H3
InChIKeyGRHUERYKPKACSX-UHFFFAOYSA-N
MW404.47 g/mol
LogP4.36
Rot. Bonds3

About 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one

6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one (PubChem CID 71705186) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one.

Molecular Properties

Compound Name6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one
PubChem CID71705186
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC Name6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one
SMILESCc1cc2oc(=O)cc(-c3cc4c(CN5CCOCC5)cnc(C)c4o3)c2cc1C
InChIInChI=1S/C24H24N2O4/c1-14-8-19-20(11-23(27)29-21(19)9-15(14)2)22-10-18-17(12-25-16(3)24(18)30-22)13-26-4-6-28-7-5-26/h8-12H,4-7,13H2,1-3H3
InChIKeyGRHUERYKPKACSX-UHFFFAOYSA-N
XLogP4.36
TPSA68.71 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

Analyze 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one with MolForge

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Related Compounds

4-[4-(azepan-1-ylmethyl)-7-methylfuro[2,3-c]pyridin-2-yl]-6,7-dimethylchromen-2-one
CID 71709741
4-[4-(azepan-1-ylmethyl)-7-methylfuro[2,3-c]pyridin-2-yl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one;hydrochloride
CID 71825485
7-methyl-4-[7-methyl-4-(piperidin-1-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one
CID 71703081
8-[4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-7-methylfuro[2,3-c]pyridin-2-yl]-[1,3]dioxolo[4,5-g]chromen-6-one;dihydrochloride
CID 71829012
6,7-dimethyl-4-[7-methyl-4-[(2-methylpropylamino)methyl]furo[2,3-c]pyridin-2-yl]chromen-2-one;hydrochloride
CID 71825978
7-methyl-4-[7-methyl-4-[[4-(pyridin-3-ylmethyl)piperazin-1-yl]methyl]furo[2,3-c]pyridin-2-yl]chromen-2-one
CID 71705009
4-[4-[[2-(2-hydroxyethyl)piperidin-1-yl]methyl]-7-methylfuro[2,3-c]pyridin-2-yl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one
CID 71825554
4-[4-[[2-(2-hydroxyethyl)piperidin-1-yl]methyl]-7-methylfuro[2,3-c]pyridin-2-yl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one;hydrochloride
CID 71825553
4-[4-[[(2R)-2-(2-hydroxyethyl)piperidin-1-yl]methyl]-7-methylfuro[2,3-c]pyridin-2-yl]-7-methylchromen-2-one
CID 97266324
(4-bromophenyl)-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]methanone
CID 71709369
4-[4-[(2-methoxyethylamino)methyl]-7-methylfuro[2,3-c]pyridin-2-yl]-7-methylchromen-2-one
CID 71827296
4-[(4-acetylpiperazin-1-yl)methyl]-6,7-dimethylchromen-2-one
CID 2101263

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one?
The IUPAC name of 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one (CID 71705186) is 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one.
What is the SMILES notation for 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one?
The canonical SMILES for 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one is Cc1cc2oc(=O)cc(-c3cc4c(CN5CCOCC5)cnc(C)c4o3)c2cc1C.
What is the InChIKey of 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one?
The InChIKey is GRHUERYKPKACSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-14-8-19-20(11-23(27)29-21(19)9-15(14)2)22-10-18-17(12-25-16(3)24(18)30-22)13-26-4-6-28-7-5-26/h8-12H,4-7,13H2,1-3H3.
What are the key properties of 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one?
6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one has a molecular weight of 404.47 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-4-[7-methyl-4-(morpholin-4-ylmethyl)furo[2,3-c]pyridin-2-yl]chromen-2-one is sourced from PubChem (CID 71705186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).