N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide

C17H20N2O5S — CID 95134899

IUPACN-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide
SMILESCc1cc2c(cc1O)NC(=O)C[C@H]2c1ccc(CN(C)S(C)(=O)=O)o1
InChIInChI=1S/C17H20N2O5S/c1-10-6-12-13(7-17(21)18-14(12)8-15(10)20)16-5-4-11(24-16)9-19(2)25(3,22)23/h4-6,8,13,20H,7,9H2,1-3H3,(H,18,21)/t13-/m1/s1
InChIKeyOLNDUWMTLKFTAZ-CYBMUJFWSA-N
MW364.42 g/mol
LogP2.16
Rot. Bonds4

About N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide

N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide (PubChem CID 95134899) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide
PubChem CID95134899
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC NameN-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide
SMILESCc1cc2c(cc1O)NC(=O)C[C@H]2c1ccc(CN(C)S(C)(=O)=O)o1
InChIInChI=1S/C17H20N2O5S/c1-10-6-12-13(7-17(21)18-14(12)8-15(10)20)16-5-4-11(24-16)9-19(2)25(3,22)23/h4-6,8,13,20H,7,9H2,1-3H3,(H,18,21)/t13-/m1/s1
InChIKeyOLNDUWMTLKFTAZ-CYBMUJFWSA-N
XLogP2.16
TPSA99.85 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide with MolForge

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Related Compounds

(4R)-4-[5-[[methyl(methylsulfonyl)amino]methyl]furan-2-yl]-6-oxo-2,4,5,7-tetrahydropyrazolo[3,4-b]pyridine-3-carboxylic acid
CID 136713831
7-hydroxy-6-methyl-4-(1-methylindol-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 50958514
ethyl 5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]-2-oxo-1,3-dihydroimidazole-4-carboxylate
CID 95122995
6,7-dimethoxy-4-(5-methylfuran-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 2988534
(4R)-4-[2,4-dimethyl-5-(1,2,4-triazol-1-ylmethyl)phenyl]-7-hydroxy-6-methyl-3,4-dihydro-1H-quinolin-2-one
CID 95132979
4-(3-ethoxy-4-propan-2-yloxyphenyl)-7-hydroxy-6-methyl-3,4-dihydro-1H-quinolin-2-one
CID 171386680
methyl 6-[(4S)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]pyridine-2-carboxylate
CID 95149140
7-hydroxy-6-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 170507807
3-[(4S)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]-6-methoxy-1H-quinolin-2-one
CID 95138160
(4R)-7-hydroxy-4-[1-(4-methoxyphenyl)imidazol-2-yl]-6-methyl-3,4-dihydro-1H-quinolin-2-one
CID 95120058
N-methyl-N-[[5-[[(2R)-2-methyl-5-oxo-1,4-diazepan-1-yl]methyl]furan-2-yl]methyl]methanesulfonamide
CID 95403122
4-[3-(4-fluorophenyl)pyrazolidin-4-yl]-7-hydroxy-6-methyl-3,4-dihydro-1H-quinolin-2-one
CID 75592833

Frequently Asked Questions

What is the IUPAC name of N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide?
The IUPAC name of N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide (CID 95134899) is N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide.
What is the SMILES notation for N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide?
The canonical SMILES for N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide is Cc1cc2c(cc1O)NC(=O)C[C@H]2c1ccc(CN(C)S(C)(=O)=O)o1.
What is the InChIKey of N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide?
The InChIKey is OLNDUWMTLKFTAZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-10-6-12-13(7-17(21)18-14(12)8-15(10)20)16-5-4-11(24-16)9-19(2)25(3,22)23/h4-6,8,13,20H,7,9H2,1-3H3,(H,18,21)/t13-/m1/s1.
What are the key properties of N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide?
N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide has a molecular weight of 364.42 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(4R)-7-hydroxy-6-methyl-2-oxo-3,4-dihydro-1H-quinolin-4-yl]furan-2-yl]methyl]-N-methylmethanesulfonamide is sourced from PubChem (CID 95134899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).