7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine

C18H23FN4O3S — CID 133308322

IUPAC7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine
SMILESO=S(=O)(N1CCOCC1)N1CCC(Nc2ccnc3cc(F)ccc23)CC1
InChIInChI=1S/C18H23FN4O3S/c19-14-1-2-16-17(3-6-20-18(16)13-14)21-15-4-7-22(8-5-15)27(24,25)23-9-11-26-12-10-23/h1-3,6,13,15H,4-5,7-12H2,(H,20,21)
InChIKeyVICCSOMSIPZNJN-UHFFFAOYSA-N
MW394.47 g/mol
LogP1.83
Rot. Bonds4

About 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine

7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine (PubChem CID 133308322) has the molecular formula C18H23FN4O3S and a molecular weight of 394.47 g/mol. Its IUPAC name is 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine.

Molecular Properties

Compound Name7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine
PubChem CID133308322
Molecular FormulaC18H23FN4O3S
Molecular Weight394.47 g/mol
Exact Mass394.15
IUPAC Name7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine
SMILESO=S(=O)(N1CCOCC1)N1CCC(Nc2ccnc3cc(F)ccc23)CC1
InChIInChI=1S/C18H23FN4O3S/c19-14-1-2-16-17(3-6-20-18(16)13-14)21-15-4-7-22(8-5-15)27(24,25)23-9-11-26-12-10-23/h1-3,6,13,15H,4-5,7-12H2,(H,20,21)
InChIKeyVICCSOMSIPZNJN-UHFFFAOYSA-N
XLogP1.83
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.47
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-cyclopropylsulfonylpiperidin-4-yl)-7-fluoroquinolin-4-amine
CID 133348527
6-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)pyridin-2-amine
CID 133308336
6-fluoro-N-piperidin-4-ylquinolin-4-amine
CID 68720863
N-(2-morpholin-4-ylsulfonylethyl)-7-(trifluoromethyl)quinolin-4-amine
CID 133405255
6-fluoro-N-[(3R)-pyrrolidin-3-yl]quinolin-4-amine
CID 68720572
7-fluoro-N-(oxan-4-yl)pyrimido[1,6-b]indazol-3-amine
CID 164602573
N-(3-bromo-5-morpholin-4-yl-2-nitrophenyl)-7-fluoroquinolin-4-amine
CID 134362165
tert-butyl 3-[(6-fluoroquinolin-4-yl)amino]pyrrolidine-1-carboxylate
CID 175301027
N-(2-cyclopropylethyl)-7-fluoroquinolin-4-amine
CID 133324339
7-chloro-N-(1-propylpiperidin-4-yl)quinolin-4-amine
CID 60667072
7-chloro-N-[(3R)-1-methylpyrrolidin-3-yl]quinolin-4-amine
CID 57199203
7-fluoro-N-(1-methylsulfonylpiperidin-4-yl)quinolin-2-amine
CID 71871267

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine?
The IUPAC name of 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine (CID 133308322) is 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine.
What is the SMILES notation for 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine?
The canonical SMILES for 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine is O=S(=O)(N1CCOCC1)N1CCC(Nc2ccnc3cc(F)ccc23)CC1.
What is the InChIKey of 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine?
The InChIKey is VICCSOMSIPZNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FN4O3S/c19-14-1-2-16-17(3-6-20-18(16)13-14)21-15-4-7-22(8-5-15)27(24,25)23-9-11-26-12-10-23/h1-3,6,13,15H,4-5,7-12H2,(H,20,21).
What are the key properties of 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine?
7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine has a molecular weight of 394.47 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N-(1-morpholin-4-ylsulfonylpiperidin-4-yl)quinolin-4-amine is sourced from PubChem (CID 133308322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).