5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine

C9H13N3O3S2 — CID 62159105

IUPAC5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine
SMILESNc1ccc(S(=O)(=O)N2CCS(=O)CC2)cn1
InChIInChI=1S/C9H13N3O3S2/c10-9-2-1-8(7-11-9)17(14,15)12-3-5-16(13)6-4-12/h1-2,7H,3-6H2,(H2,10,11)
InChIKeyWFLRAQSFNDIFAG-UHFFFAOYSA-N
MW275.35 g/mol
LogP-0.58
Rot. Bonds2

About 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine

5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine (PubChem CID 62159105) has the molecular formula C9H13N3O3S2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine
PubChem CID62159105
Molecular FormulaC9H13N3O3S2
Molecular Weight275.35 g/mol
Exact Mass275.04
IUPAC Name5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine
SMILESNc1ccc(S(=O)(=O)N2CCS(=O)CC2)cn1
InChIInChI=1S/C9H13N3O3S2/c10-9-2-1-8(7-11-9)17(14,15)12-3-5-16(13)6-4-12/h1-2,7H,3-6H2,(H2,10,11)
InChIKeyWFLRAQSFNDIFAG-UHFFFAOYSA-N
XLogP-0.58
TPSA93.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 5-0.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine
CID 62157663
4-(2-chloropyrimidin-5-yl)sulfonyl-1,4-thiazinane 1-oxide
CID 54975901
2-chloro-4-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]aniline
CID 113288420
2-methyl-5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]aniline
CID 54977271
5-(4-cyclopentylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62369821
1-[1-[(6-amino-3-pyridinyl)sulfonyl]piperidin-4-yl]ethanol
CID 106835157
5-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ylsulfonyl)pyridin-2-amine
CID 62147207
5-(3-morpholin-4-ylpyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 63174663
5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylsulfonyl)pyridin-2-amine
CID 63020721
5-[[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]sulfonyl]pyridin-2-amine
CID 114489388
(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine
CID 114613060
5-[(2-methyl-1,4-oxazepan-4-yl)sulfonyl]pyridin-2-amine
CID 62968539

Frequently Asked Questions

What is the IUPAC name of 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine?
The IUPAC name of 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine (CID 62159105) is 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine.
What is the SMILES notation for 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine?
The canonical SMILES for 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine is Nc1ccc(S(=O)(=O)N2CCS(=O)CC2)cn1.
What is the InChIKey of 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine?
The InChIKey is WFLRAQSFNDIFAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3S2/c10-9-2-1-8(7-11-9)17(14,15)12-3-5-16(13)6-4-12/h1-2,7H,3-6H2,(H2,10,11).
What are the key properties of 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine?
5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine has a molecular weight of 275.35 g/mol, XLogP of -0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine is sourced from PubChem (CID 62159105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).