N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide

C25H26N4O4 — CID 170309320

IUPACN-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2cc3c(nc2N2CC4CC2(C)C4)COC3)cc2c(C)cc(=O)[nH]c12
InChIInChI=1S/C25H26N4O4/c1-13-4-21(30)28-22-17(13)6-16(7-20(22)32-3)26-24(31)18-5-15-11-33-12-19(15)27-23(18)29-10-14-8-25(29,2)9-14/h4-7,14H,8-12H2,1-3H3,(H,26,31)(H,28,30)
InChIKeyJIFQHMFJMSSSEA-UHFFFAOYSA-N
MW446.51 g/mol
LogP3.51
Rot. Bonds4

About N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide

N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide (PubChem CID 170309320) has the molecular formula C25H26N4O4 and a molecular weight of 446.51 g/mol. Its IUPAC name is N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide
PubChem CID170309320
Molecular FormulaC25H26N4O4
Molecular Weight446.51 g/mol
Exact Mass446.20
IUPAC NameN-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2cc3c(nc2N2CC4CC2(C)C4)COC3)cc2c(C)cc(=O)[nH]c12
InChIInChI=1S/C25H26N4O4/c1-13-4-21(30)28-22-17(13)6-16(7-20(22)32-3)26-24(31)18-5-15-11-33-12-19(15)27-23(18)29-10-14-8-25(29,2)9-14/h4-7,14H,8-12H2,1-3H3,(H,26,31)(H,28,30)
InChIKeyJIFQHMFJMSSSEA-UHFFFAOYSA-N
XLogP3.51
TPSA96.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.51
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-[(2S)-2-methylpyrrolidin-1-yl]-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide
CID 170309307
2-(3,3-difluoropyrrolidin-1-yl)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide
CID 169247762
tert-butyl N-methyl-N-[2-[[4-methyl-6-[(2-morpholin-4-yl-5,7-dihydrofuro[3,4-b]pyridine-3-carbonyl)amino]-2-oxo-1H-quinolin-8-yl]oxy]ethyl]carbamate
CID 170309325
N-(7-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-5-(1-methylpyrazol-4-yl)-2-morpholin-4-ylpyridine-3-carboxamide
CID 118694909
(E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide
CID 169247733
5-isocyano-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide
CID 140820718
5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide
CID 118694872
2-[2-(methoxymethyl)morpholin-4-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-5-(morpholin-4-ylmethyl)pyridine-3-carboxamide
CID 118695003
N-(5,8-dimethoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-3-oxobutanamide
CID 15757685
6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane
CID 169247715
2-[3-(hydroxymethyl)morpholin-4-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)pyridine-3-carboxamide
CID 118695126
N-(4-methoxy-2,5-dimethylphenyl)-2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide
CID 135402516

Frequently Asked Questions

What is the IUPAC name of N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide?
The IUPAC name of N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide (CID 170309320) is N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide.
What is the SMILES notation for N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide?
The canonical SMILES for N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide is COc1cc(NC(=O)c2cc3c(nc2N2CC4CC2(C)C4)COC3)cc2c(C)cc(=O)[nH]c12.
What is the InChIKey of N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide?
The InChIKey is JIFQHMFJMSSSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O4/c1-13-4-21(30)28-22-17(13)6-16(7-20(22)32-3)26-24(31)18-5-15-11-33-12-19(15)27-23(18)29-10-14-8-25(29,2)9-14/h4-7,14H,8-12H2,1-3H3,(H,26,31)(H,28,30).
What are the key properties of N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide?
N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide has a molecular weight of 446.51 g/mol, XLogP of 3.51, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-(1-methyl-2-azabicyclo[2.1.1]hexan-2-yl)-5,7-dihydrofuro[3,4-b]pyridine-3-carboxamide is sourced from PubChem (CID 170309320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).