N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide

C16H21N3O3S — CID 167805211

IUPACN,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide
SMILESCc1ccc2cccnc2c1S(=O)(=O)N(C)CC1COCCN1
InChIInChI=1S/C16H21N3O3S/c1-12-5-6-13-4-3-7-18-15(13)16(12)23(20,21)19(2)10-14-11-22-9-8-17-14/h3-7,14,17H,8-11H2,1-2H3
InChIKeyAYXCKGRQUHFQFT-UHFFFAOYSA-N
MW335.43 g/mol
LogP1.15
Rot. Bonds4

About N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide

N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide (PubChem CID 167805211) has the molecular formula C16H21N3O3S and a molecular weight of 335.43 g/mol. Its IUPAC name is N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide.

Molecular Properties

Compound NameN,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide
PubChem CID167805211
Molecular FormulaC16H21N3O3S
Molecular Weight335.43 g/mol
Exact Mass335.13
IUPAC NameN,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide
SMILESCc1ccc2cccnc2c1S(=O)(=O)N(C)CC1COCCN1
InChIInChI=1S/C16H21N3O3S/c1-12-5-6-13-4-3-7-18-15(13)16(12)23(20,21)19(2)10-14-11-22-9-8-17-14/h3-7,14,17H,8-11H2,1-2H3
InChIKeyAYXCKGRQUHFQFT-UHFFFAOYSA-N
XLogP1.15
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.43
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(7-methylquinolin-8-yl)sulfonylamino]-3-(oxolan-3-yl)propanoic acid
CID 146128051
2-methyl-N-(morpholin-3-ylmethyl)pyridine-3-carboxamide
CID 103548430
N-methyl-N-[[(5R)-3-phenyl-4,5-dihydro-1,2-oxazol-5-yl]methyl]quinoline-8-sulfonamide
CID 7347486
6-amino-N,2,3-trimethyl-N-(oxan-3-ylmethyl)benzenesulfonamide
CID 63727637
4,7-dimethyl-2-(morpholin-3-ylmethyl)isoindole-1,3-dione
CID 103549560
2-amino-N,3,6-trimethyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 103171510
2-methyl-N-(morpholin-3-ylmethyl)-6-nitrobenzenesulfonamide
CID 103548838
N-(morpholin-3-ylmethyl)-2-pyridin-2-ylethanesulfonamide
CID 103548911
7-methyl-N-[2-(methylamino)propyl]quinoline-8-sulfonamide;hydrochloride
CID 120824315
3-(benzenesulfonylmethyl)morpholine
CID 117037196
N,6-dimethyl-N-(morpholin-3-ylmethyl)-1,3-benzodioxol-5-amine
CID 115237974
4-ethylsulfanyl-N-methyl-N-(morpholin-3-ylmethyl)aniline
CID 115237955

Frequently Asked Questions

What is the IUPAC name of N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide?
The IUPAC name of N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide (CID 167805211) is N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide.
What is the SMILES notation for N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide?
The canonical SMILES for N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide is Cc1ccc2cccnc2c1S(=O)(=O)N(C)CC1COCCN1.
What is the InChIKey of N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide?
The InChIKey is AYXCKGRQUHFQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3S/c1-12-5-6-13-4-3-7-18-15(13)16(12)23(20,21)19(2)10-14-11-22-9-8-17-14/h3-7,14,17H,8-11H2,1-2H3.
What are the key properties of N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide?
N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide has a molecular weight of 335.43 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-dimethyl-N-(morpholin-3-ylmethyl)quinoline-8-sulfonamide is sourced from PubChem (CID 167805211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).