3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine

C11H15NS — CID 130667718

IUPAC3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine
SMILESCC1(C2=CSC3=CCCCN32)CC1
InChIInChI=1S/C11H15NS/c1-11(5-6-11)9-8-13-10-4-2-3-7-12(9)10/h4,8H,2-3,5-7H2,1H3
InChIKeyHKDBTPMOIOKUDU-UHFFFAOYSA-N
MW193.31 g/mol
LogP3.31
Rot. Bonds1

About 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine

3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine (PubChem CID 130667718) has the molecular formula C11H15NS and a molecular weight of 193.31 g/mol. Its IUPAC name is 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine.

Molecular Properties

Compound Name3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine
PubChem CID130667718
Molecular FormulaC11H15NS
Molecular Weight193.31 g/mol
Exact Mass193.09
IUPAC Name3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine
SMILESCC1(C2=CSC3=CCCCN32)CC1
InChIInChI=1S/C11H15NS/c1-11(5-6-11)9-8-13-10-4-2-3-7-12(9)10/h4,8H,2-3,5-7H2,1H3
InChIKeyHKDBTPMOIOKUDU-UHFFFAOYSA-N
XLogP3.31
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.31
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine?
The IUPAC name of 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine (CID 130667718) is 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine.
What is the SMILES notation for 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine?
The canonical SMILES for 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine is CC1(C2=CSC3=CCCCN32)CC1.
What is the InChIKey of 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine?
The InChIKey is HKDBTPMOIOKUDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NS/c1-11(5-6-11)9-8-13-10-4-2-3-7-12(9)10/h4,8H,2-3,5-7H2,1H3.
What are the key properties of 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine?
3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine has a molecular weight of 193.31 g/mol, XLogP of 3.31, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylcyclopropyl)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridine is sourced from PubChem (CID 130667718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).