7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one

C23H24N4O3 — CID 1433270

IUPAC7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one
SMILESCOc1ccc2cc(-c3nc4cccc(C)n4c3NC[C@H]3CCCO3)c(=O)[nH]c2c1
InChIInChI=1S/C23H24N4O3/c1-14-5-3-7-20-26-21(22(27(14)20)24-13-17-6-4-10-30-17)18-11-15-8-9-16(29-2)12-19(15)25-23(18)28/h3,5,7-9,11-12,17,24H,4,6,10,13H2,1-2H3,(H,25,28)/t17-/m1/s1
InChIKeyXQAFKOKUTTUIKX-QGZVFWFLSA-N
MW404.47 g/mol
LogP3.75
Rot. Bonds5

About 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one

7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one (PubChem CID 1433270) has the molecular formula C23H24N4O3 and a molecular weight of 404.47 g/mol. Its IUPAC name is 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one.

Molecular Properties

Compound Name7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one
PubChem CID1433270
Molecular FormulaC23H24N4O3
Molecular Weight404.47 g/mol
Exact Mass404.18
IUPAC Name7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one
SMILESCOc1ccc2cc(-c3nc4cccc(C)n4c3NC[C@H]3CCCO3)c(=O)[nH]c2c1
InChIInChI=1S/C23H24N4O3/c1-14-5-3-7-20-26-21(22(27(14)20)24-13-17-6-4-10-30-17)18-11-15-8-9-16(29-2)12-19(15)25-23(18)28/h3,5,7-9,11-12,17,24H,4,6,10,13H2,1-2H3,(H,25,28)/t17-/m1/s1
InChIKeyXQAFKOKUTTUIKX-QGZVFWFLSA-N
XLogP3.75
TPSA80.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one with MolForge

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Launch Full Analysis

Related Compounds

8-methyl-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one
CID 1433098
7-methoxy-3-[5-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one
CID 158658096
3-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one
CID 1433253
3-[6-chloro-3-(cyclopentylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one
CID 1433274
1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1,3-bis(oxolan-2-ylmethyl)thiourea
CID 3172217
1-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(oxolan-2-ylmethyl)thiourea
CID 3172144
1-(furan-2-ylmethyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(oxolan-2-ylmethyl)thiourea
CID 3169347
N-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-2-(oxan-2-yl)acetamide
CID 110609197
1-[(4-fluorophenyl)methyl]-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(oxolan-2-ylmethyl)thiourea
CID 3172235
1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-[[(2R)-oxolan-2-yl]methyl]thiourea
CID 1137598
7-methoxy-3-[[[2-methyl-1-[1-(2-methylbutan-2-yl)tetrazol-5-yl]propyl]-(oxolan-2-ylmethyl)amino]methyl]-1H-quinolin-2-one
CID 3203119
1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methylphenyl)-1-[[(2S)-oxolan-2-yl]methyl]thiourea
CID 1137590

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one?
The IUPAC name of 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one (CID 1433270) is 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one.
What is the SMILES notation for 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one?
The canonical SMILES for 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one is COc1ccc2cc(-c3nc4cccc(C)n4c3NC[C@H]3CCCO3)c(=O)[nH]c2c1.
What is the InChIKey of 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one?
The InChIKey is XQAFKOKUTTUIKX-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H24N4O3/c1-14-5-3-7-20-26-21(22(27(14)20)24-13-17-6-4-10-30-17)18-11-15-8-9-16(29-2)12-19(15)25-23(18)28/h3,5,7-9,11-12,17,24H,4,6,10,13H2,1-2H3,(H,25,28)/t17-/m1/s1.
What are the key properties of 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one?
7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one has a molecular weight of 404.47 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3-[5-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-2-one is sourced from PubChem (CID 1433270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).