5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine

C15H19N3O2S — CID 104774086

IUPAC5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine
SMILESCC1CC(N)CN(S(=O)(=O)c2cccc3ncccc23)C1
InChIInChI=1S/C15H19N3O2S/c1-11-8-12(16)10-18(9-11)21(19,20)15-6-2-5-14-13(15)4-3-7-17-14/h2-7,11-12H,8-10,16H2,1H3
InChIKeyKCOXYIXLDDDDDV-UHFFFAOYSA-N
MW305.40 g/mol
LogP1.59
Rot. Bonds2

About 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine

5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine (PubChem CID 104774086) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine.

Molecular Properties

Compound Name5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine
PubChem CID104774086
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine
SMILESCC1CC(N)CN(S(=O)(=O)c2cccc3ncccc23)C1
InChIInChI=1S/C15H19N3O2S/c1-11-8-12(16)10-18(9-11)21(19,20)15-6-2-5-14-13(15)4-3-7-17-14/h2-7,11-12H,8-10,16H2,1H3
InChIKeyKCOXYIXLDDDDDV-UHFFFAOYSA-N
XLogP1.59
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-1-(1H-pyrrolo[2,3-b]pyridin-3-ylsulfonyl)piperidin-3-amine
CID 79993772
1-quinolin-5-ylsulfonylpiperidin-4-amine
CID 115752090
5-(4-methylpiperazin-1-yl)sulfonylquinoline
CID 115599575
2-(1-quinolin-5-ylsulfonylpyrrolidin-3-yl)ethanamine
CID 114802283
3-methyl-1-quinolin-5-ylsulfonylpiperidin-4-one
CID 114500121
1-(3-chloro-2-fluorophenyl)sulfonyl-5-methylpiperidin-3-amine
CID 79994182
(3-amino-5-methylpiperidin-1-yl)-quinolin-5-ylmethanone
CID 79992741
3-methyl-1-quinolin-5-ylsulfonylazetidin-3-ol
CID 104773999
5-(4-bromopiperidin-1-yl)sulfonylquinoline
CID 104774213
2-(1-quinolin-5-ylsulfonylpyrrolidin-3-yl)ethanol
CID 115745017
3-(3,5-dimethylpiperidin-1-yl)sulfonylpyridine-2-carbothioamide
CID 106596381
(2-pyridin-4-yl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)-(1-quinolin-5-ylsulfonylazetidin-3-yl)methanone
CID 62705833

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine?
The IUPAC name of 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine (CID 104774086) is 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine.
What is the SMILES notation for 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine?
The canonical SMILES for 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine is CC1CC(N)CN(S(=O)(=O)c2cccc3ncccc23)C1.
What is the InChIKey of 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine?
The InChIKey is KCOXYIXLDDDDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-11-8-12(16)10-18(9-11)21(19,20)15-6-2-5-14-13(15)4-3-7-17-14/h2-7,11-12H,8-10,16H2,1H3.
What are the key properties of 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine?
5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine has a molecular weight of 305.40 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-quinolin-5-ylsulfonylpiperidin-3-amine is sourced from PubChem (CID 104774086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).