4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole

C10H14N2S — CID 141160743

IUPAC4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole
SMILESC[C@@H]1CC=C(c2cscn2)CN1C
InChIInChI=1S/C10H14N2S/c1-8-3-4-9(5-12(8)2)10-6-13-7-11-10/h4,6-8H,3,5H2,1-2H3/t8-/m1/s1
InChIKeyAIZRLKHJHSJFRF-MRVPVSSYSA-N
MW194.30 g/mol
LogP2.25
Rot. Bonds1

About 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole

4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole (PubChem CID 141160743) has the molecular formula C10H14N2S and a molecular weight of 194.30 g/mol. Its IUPAC name is 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole.

Molecular Properties

Compound Name4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole
PubChem CID141160743
Molecular FormulaC10H14N2S
Molecular Weight194.30 g/mol
Exact Mass194.09
IUPAC Name4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole
SMILESC[C@@H]1CC=C(c2cscn2)CN1C
InChIInChI=1S/C10H14N2S/c1-8-3-4-9(5-12(8)2)10-6-13-7-11-10/h4,6-8H,3,5H2,1-2H3/t8-/m1/s1
InChIKeyAIZRLKHJHSJFRF-MRVPVSSYSA-N
XLogP2.25
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole?
The IUPAC name of 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole (CID 141160743) is 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole.
What is the SMILES notation for 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole?
The canonical SMILES for 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole is C[C@@H]1CC=C(c2cscn2)CN1C.
What is the InChIKey of 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole?
The InChIKey is AIZRLKHJHSJFRF-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14N2S/c1-8-3-4-9(5-12(8)2)10-6-13-7-11-10/h4,6-8H,3,5H2,1-2H3/t8-/m1/s1.
What are the key properties of 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole?
4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole has a molecular weight of 194.30 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-1,2-dimethyl-3,6-dihydro-2H-pyridin-5-yl]-1,3-thiazole is sourced from PubChem (CID 141160743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).