2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide

C20H28N4O4S — CID 92638952

IUPAC2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide
SMILESCCN(CC)S(=O)(=O)N1CCO[C@@H](c2cc(C(=O)N(C)C)c3ccccc3n2)C1
InChIInChI=1S/C20H28N4O4S/c1-5-23(6-2)29(26,27)24-11-12-28-19(14-24)18-13-16(20(25)22(3)4)15-9-7-8-10-17(15)21-18/h7-10,13,19H,5-6,11-12,14H2,1-4H3/t19-/m1/s1
InChIKeySAXUCUQHBMWKBL-LJQANCHMSA-N
MW420.54 g/mol
LogP1.90
Rot. Bonds6

About 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide

2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide (PubChem CID 92638952) has the molecular formula C20H28N4O4S and a molecular weight of 420.54 g/mol. Its IUPAC name is 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide.

Molecular Properties

Compound Name2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide
PubChem CID92638952
Molecular FormulaC20H28N4O4S
Molecular Weight420.54 g/mol
Exact Mass420.18
IUPAC Name2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide
SMILESCCN(CC)S(=O)(=O)N1CCO[C@@H](c2cc(C(=O)N(C)C)c3ccccc3n2)C1
InChIInChI=1S/C20H28N4O4S/c1-5-23(6-2)29(26,27)24-11-12-28-19(14-24)18-13-16(20(25)22(3)4)15-9-7-8-10-17(15)21-18/h7-10,13,19H,5-6,11-12,14H2,1-4H3/t19-/m1/s1
InChIKeySAXUCUQHBMWKBL-LJQANCHMSA-N
XLogP1.90
TPSA83.05 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.54
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-2-[(2R)-4-[(E)-2-methyl-3-phenylprop-2-enyl]morpholin-2-yl]quinoline-4-carboxamide
CID 92638391
N,N-dimethyl-2-[(2S)-4-(2-pyridin-2-ylacetyl)morpholin-2-yl]quinoline-4-carboxamide
CID 95812995
2-[(2S)-4-[3-(4-fluorophenyl)propanoyl]morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide
CID 95812989
N,N-dimethyl-2-[4-[(2-propan-2-yloxyphenyl)methyl]morpholin-2-yl]quinoline-4-carboxamide
CID 110251738
N,N-dimethyl-2-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]quinoline-4-carboxamide
CID 92638317
N,N-dimethyl-2-[(2R)-4-(5-methyl-3-propan-2-yl-1,2-oxazole-4-carbonyl)morpholin-2-yl]quinoline-4-carboxamide
CID 92639254
N,N-dimethyl-2-[4-(5-methyl-3-propan-2-yl-1,2-oxazole-4-carbonyl)morpholin-2-yl]quinoline-4-carboxamide
CID 110251734
2-[(2R)-4-methylmorpholin-2-yl]-N-(2-methylpropyl)quinoline-4-carboxamide
CID 92638375
2-[4-(3,4-dimethylphenyl)sulfonylmorpholin-2-yl]-N-methylquinoline-4-carboxamide
CID 110251822
(2R)-2-[4-[(2-chlorophenyl)methyl]-6-methyl-2-pyridinyl]-N,N-diethylmorpholine-4-sulfonamide
CID 124978058
N-(2-hydroxyethyl)-N-methyl-2-[(2S)-4-(2-piperidin-1-ylacetyl)morpholin-2-yl]quinoline-4-carboxamide
CID 92638296
N,N-diethyl-4-(2-phenylquinoline-4-carbonyl)piperazine-1-sulfonamide
CID 24584448

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide?
The IUPAC name of 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide (CID 92638952) is 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide.
What is the SMILES notation for 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide?
The canonical SMILES for 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide is CCN(CC)S(=O)(=O)N1CCO[C@@H](c2cc(C(=O)N(C)C)c3ccccc3n2)C1.
What is the InChIKey of 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide?
The InChIKey is SAXUCUQHBMWKBL-LJQANCHMSA-N. The full InChI is InChI=1S/C20H28N4O4S/c1-5-23(6-2)29(26,27)24-11-12-28-19(14-24)18-13-16(20(25)22(3)4)15-9-7-8-10-17(15)21-18/h7-10,13,19H,5-6,11-12,14H2,1-4H3/t19-/m1/s1.
What are the key properties of 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide?
2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide has a molecular weight of 420.54 g/mol, XLogP of 1.90, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide is sourced from PubChem (CID 92638952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).