N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide

C18H25N3O2S — CID 138029984

IUPACN,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide
SMILESCCN(CC)S(=O)(=O)N1CCC(c2ccnc3ccccc23)CC1
InChIInChI=1S/C18H25N3O2S/c1-3-20(4-2)24(22,23)21-13-10-15(11-14-21)16-9-12-19-18-8-6-5-7-17(16)18/h5-9,12,15H,3-4,10-11,13-14H2,1-2H3
InChIKeyMERIKOHMFQVHQE-UHFFFAOYSA-N
MW347.48 g/mol
LogP3.00
Rot. Bonds5

About N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide

N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide (PubChem CID 138029984) has the molecular formula C18H25N3O2S and a molecular weight of 347.48 g/mol. Its IUPAC name is N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide
PubChem CID138029984
Molecular FormulaC18H25N3O2S
Molecular Weight347.48 g/mol
Exact Mass347.17
IUPAC NameN,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide
SMILESCCN(CC)S(=O)(=O)N1CCC(c2ccnc3ccccc23)CC1
InChIInChI=1S/C18H25N3O2S/c1-3-20(4-2)24(22,23)21-13-10-15(11-14-21)16-9-12-19-18-8-6-5-7-17(16)18/h5-9,12,15H,3-4,10-11,13-14H2,1-2H3
InChIKeyMERIKOHMFQVHQE-UHFFFAOYSA-N
XLogP3.00
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.48
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclopentylquinoline
CID 57273226
N,N-diethyl-4-pyrazin-2-ylpiperidine-1-sulfonamide
CID 125019512
(2-ethyl-5-methyl-1,3-oxazol-4-yl)-(4-quinolin-4-ylpiperidin-1-yl)methanone
CID 138035846
(NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine
CID 139429293
N,N-diethyl-4-[5-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidine-1-sulfonamide
CID 95834146
N,N-bis(2-methylpropyl)-2-(4-quinolin-4-ylcyclohexyl)acetamide
CID 139302691
4-quinolin-5-ylcyclohexan-1-one
CID 83261338
[5-cyclopropyl-6-(4-quinolin-4-ylcyclohexanecarbonyl)-2-pyridinyl]methyl carbamate
CID 175211489
4-(1,3-benzoxazol-2-yl)-N,N-diethylpiperazine-1-sulfonamide
CID 33324562
2-[(2R)-4-(diethylsulfamoyl)morpholin-2-yl]-N,N-dimethylquinoline-4-carboxamide
CID 92638952
N-(cyclopropylmethyl)-N-methyl-3-quinazolin-4-ylpyrrolidine-1-sulfonamide
CID 155957936
N,N-diethyl-4-(2-phenylquinoline-4-carbonyl)piperazine-1-sulfonamide
CID 24584448

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide?
The IUPAC name of N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide (CID 138029984) is N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide.
What is the SMILES notation for N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide?
The canonical SMILES for N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide is CCN(CC)S(=O)(=O)N1CCC(c2ccnc3ccccc23)CC1.
What is the InChIKey of N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide?
The InChIKey is MERIKOHMFQVHQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2S/c1-3-20(4-2)24(22,23)21-13-10-15(11-14-21)16-9-12-19-18-8-6-5-7-17(16)18/h5-9,12,15H,3-4,10-11,13-14H2,1-2H3.
What are the key properties of N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide?
N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide has a molecular weight of 347.48 g/mol, XLogP of 3.00, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide is sourced from PubChem (CID 138029984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).