1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one

C19H24N4O5S — CID 46979096

IUPAC1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one
SMILESCn1c(=O)cc(C(=O)N2CCN(S(=O)(=O)N3CCOCC3)CC2)c2ccccc21
InChIInChI=1S/C19H24N4O5S/c1-20-17-5-3-2-4-15(17)16(14-18(20)24)19(25)21-6-8-22(9-7-21)29(26,27)23-10-12-28-13-11-23/h2-5,14H,6-13H2,1H3
InChIKeyWEHNUFAWPGZYCS-UHFFFAOYSA-N
MW420.49 g/mol
LogP-0.13
Rot. Bonds3

About 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one

1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one (PubChem CID 46979096) has the molecular formula C19H24N4O5S and a molecular weight of 420.49 g/mol. Its IUPAC name is 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one.

Molecular Properties

Compound Name1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one
PubChem CID46979096
Molecular FormulaC19H24N4O5S
Molecular Weight420.49 g/mol
Exact Mass420.15
IUPAC Name1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one
SMILESCn1c(=O)cc(C(=O)N2CCN(S(=O)(=O)N3CCOCC3)CC2)c2ccccc21
InChIInChI=1S/C19H24N4O5S/c1-20-17-5-3-2-4-15(17)16(14-18(20)24)19(25)21-6-8-22(9-7-21)29(26,27)23-10-12-28-13-11-23/h2-5,14H,6-13H2,1H3
InChIKeyWEHNUFAWPGZYCS-UHFFFAOYSA-N
XLogP-0.13
TPSA92.16 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.49
LogP ≤ 5-0.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-4-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]quinolin-2-one
CID 55755455
4-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-1-methylquinolin-2-one
CID 55754602
4-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-1-methylquinolin-2-one
CID 110694493
2-[4-(1-methyl-2-oxoquinoline-4-carbonyl)piperazin-1-yl]-2-oxo-N-propan-2-ylacetamide
CID 55759278
N-[1-(1-methyl-2-oxoquinoline-4-carbonyl)piperidin-4-yl]benzenesulfonamide
CID 55790694
1-methyl-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-2-oxoquinoline-4-carboxamide
CID 55758321
4-[4-[1-(2-chlorophenyl)ethyl]piperazine-1-carbonyl]-1-methylquinolin-2-one
CID 55761742
N-(5-methyl-1,2-oxazol-3-yl)-1-(1-methyl-2-oxoquinoline-4-carbonyl)piperidine-4-carboxamide
CID 55758260
4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)-2-propan-2-ylphthalazin-1-one
CID 55563618
(3-bromo-1-methylindol-2-yl)-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone
CID 154807142
4-[(3S)-3-aminoazepane-1-carbonyl]-1-methylquinolin-2-one
CID 96574654
(1,5-dimethylindol-2-yl)-(4-morpholin-4-ylsulfonylpiperazin-1-yl)methanone
CID 46979809

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one?
The IUPAC name of 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one (CID 46979096) is 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one.
What is the SMILES notation for 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one?
The canonical SMILES for 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one is Cn1c(=O)cc(C(=O)N2CCN(S(=O)(=O)N3CCOCC3)CC2)c2ccccc21.
What is the InChIKey of 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one?
The InChIKey is WEHNUFAWPGZYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O5S/c1-20-17-5-3-2-4-15(17)16(14-18(20)24)19(25)21-6-8-22(9-7-21)29(26,27)23-10-12-28-13-11-23/h2-5,14H,6-13H2,1H3.
What are the key properties of 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one?
1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one has a molecular weight of 420.49 g/mol, XLogP of -0.13, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)quinolin-2-one is sourced from PubChem (CID 46979096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).