3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine

C10H15N3O2S — CID 62471359

IUPAC3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine
SMILESNc1ncccc1CN1CCS(=O)(=O)CC1
InChIInChI=1S/C10H15N3O2S/c11-10-9(2-1-3-12-10)8-13-4-6-16(14,15)7-5-13/h1-3H,4-8H2,(H2,11,12)
InChIKeyGRXLZZGDHFWJQF-UHFFFAOYSA-N
MW241.32 g/mol
LogP-0.11
Rot. Bonds2

About 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine

3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine (PubChem CID 62471359) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine
PubChem CID62471359
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine
SMILESNc1ncccc1CN1CCS(=O)(=O)CC1
InChIInChI=1S/C10H15N3O2S/c11-10-9(2-1-3-12-10)8-13-4-6-16(14,15)7-5-13/h1-3H,4-8H2,(H2,11,12)
InChIKeyGRXLZZGDHFWJQF-UHFFFAOYSA-N
XLogP-0.11
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(pyrrolidin-1-ylmethyl)pyridin-2-amine
CID 62470567
3-(piperidin-1-ylmethyl)pyridin-2-amine
CID 18771814
3-[(4-propan-2-ylpiperazin-1-yl)methyl]pyridin-2-amine
CID 62472253
1-[4-[(2-amino-3-pyridinyl)methyl]-1,4-diazepan-1-yl]ethanone
CID 62466270
3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-2-fluoroaniline
CID 107347257
4-[(3-fluoro-2-pyridinyl)methyl]-1,4-thiazinane 1,1-dioxide
CID 172880678
4-[(2-amino-3-pyridinyl)methyl]piperazin-2-one
CID 62472006
3-[(4-butan-2-ylpiperazin-1-yl)methyl]pyridin-2-amine
CID 55116433
3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]quinolin-2-amine
CID 62182409
3-[(3,4,5-trimethylpiperazin-1-yl)methyl]pyridin-2-amine
CID 114539469
2-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]ethanamine
CID 114057385
[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanol
CID 61257905

Frequently Asked Questions

What is the IUPAC name of 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine (CID 62471359) is 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine is Nc1ncccc1CN1CCS(=O)(=O)CC1.
What is the InChIKey of 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine?
The InChIKey is GRXLZZGDHFWJQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c11-10-9(2-1-3-12-10)8-13-4-6-16(14,15)7-5-13/h1-3H,4-8H2,(H2,11,12).
What are the key properties of 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine?
3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine has a molecular weight of 241.32 g/mol, XLogP of -0.11, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 62471359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).