N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide

C17H21N3O2S — CID 155800764

IUPACN-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCCN(c2ccnc3ccccc23)C1)C1CC1
InChIInChI=1S/C17H21N3O2S/c21-23(22,14-7-8-14)19-13-4-3-11-20(12-13)17-9-10-18-16-6-2-1-5-15(16)17/h1-2,5-6,9-10,13-14,19H,3-4,7-8,11-12H2
InChIKeyVIOZGWBSDNJAGK-UHFFFAOYSA-N
MW331.44 g/mol
LogP2.29
Rot. Bonds4

About N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide

N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide (PubChem CID 155800764) has the molecular formula C17H21N3O2S and a molecular weight of 331.44 g/mol. Its IUPAC name is N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide
PubChem CID155800764
Molecular FormulaC17H21N3O2S
Molecular Weight331.44 g/mol
Exact Mass331.14
IUPAC NameN-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCCN(c2ccnc3ccccc23)C1)C1CC1
InChIInChI=1S/C17H21N3O2S/c21-23(22,14-7-8-14)19-13-4-3-11-20(12-13)17-9-10-18-16-6-2-1-5-15(16)17/h1-2,5-6,9-10,13-14,19H,3-4,7-8,11-12H2
InChIKeyVIOZGWBSDNJAGK-UHFFFAOYSA-N
XLogP2.29
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.44
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-quinazolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide
CID 154829981
N-methyl-N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide
CID 163346580
N-[(3R)-1-quinazolin-4-ylpiperidin-3-yl]methanesulfonamide
CID 36834296
N-(1-pyridin-2-ylpyrrolidin-3-yl)cyclopropanesulfonamide
CID 90621445
N-methyl-N-(1-quinolin-4-ylpiperidin-4-yl)cyclopropanesulfonamide
CID 163349602
N-[1-[7-(trifluoromethyl)quinolin-4-yl]piperidin-3-yl]methanesulfonamide
CID 163354863
N-(1-pyrazin-2-ylpiperidin-3-yl)cyclopropanesulfonamide
CID 154829489
N-(1-quinazolin-4-ylpiperidin-3-yl)propane-2-sulfonamide
CID 175650317
N-[1-[7-(trifluoromethyl)quinolin-4-yl]piperidin-4-yl]cyclopropanesulfonamide
CID 154575895
N-methyl-N-(1-quinolin-4-ylpiperidin-3-yl)morpholine-4-carboxamide
CID 172892057
4-morpholin-4-yl-N-[(3R)-1-quinolin-5-ylpiperidin-3-yl]pyrimidin-2-amine
CID 171540071
1-quinolin-4-ylpiperidine-4-carbaldehyde
CID 62663267

Frequently Asked Questions

What is the IUPAC name of N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide?
The IUPAC name of N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide (CID 155800764) is N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide is O=S(=O)(NC1CCCN(c2ccnc3ccccc23)C1)C1CC1.
What is the InChIKey of N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide?
The InChIKey is VIOZGWBSDNJAGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2S/c21-23(22,14-7-8-14)19-13-4-3-11-20(12-13)17-9-10-18-16-6-2-1-5-15(16)17/h1-2,5-6,9-10,13-14,19H,3-4,7-8,11-12H2.
What are the key properties of N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide?
N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide has a molecular weight of 331.44 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide is sourced from PubChem (CID 155800764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).