N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine

C10H15N3OS — CID 142576215

IUPACN-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESC1Cc2nc(NCC3COC3)sc2CN1
InChIInChI=1S/C10H15N3OS/c1-2-11-4-9-8(1)13-10(15-9)12-3-7-5-14-6-7/h7,11H,1-6H2,(H,12,13)
InChIKeyWITRBLPHBNJPKQ-UHFFFAOYSA-N
MW225.32 g/mol
LogP0.85
Rot. Bonds3

About N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine

N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine (PubChem CID 142576215) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine.

Molecular Properties

Compound NameN-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine
PubChem CID142576215
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC NameN-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESC1Cc2nc(NCC3COC3)sc2CN1
InChIInChI=1S/C10H15N3OS/c1-2-11-4-9-8(1)13-10(15-9)12-3-7-5-14-6-7/h7,11H,1-6H2,(H,12,13)
InChIKeyWITRBLPHBNJPKQ-UHFFFAOYSA-N
XLogP0.85
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The IUPAC name of N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine (CID 142576215) is N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine.
What is the SMILES notation for N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The canonical SMILES for N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine is C1Cc2nc(NCC3COC3)sc2CN1.
What is the InChIKey of N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The InChIKey is WITRBLPHBNJPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-2-11-4-9-8(1)13-10(15-9)12-3-7-5-14-6-7/h7,11H,1-6H2,(H,12,13).
What are the key properties of N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine?
N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine has a molecular weight of 225.32 g/mol, XLogP of 0.85, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxetan-3-ylmethyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-amine is sourced from PubChem (CID 142576215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).