N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide

C11H15N3O2S — CID 61272434

IUPACN-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide
SMILESO=C(Nc1nc2c(s1)CNCC2)C1CCOC1
InChIInChI=1S/C11H15N3O2S/c15-10(7-2-4-16-6-7)14-11-13-8-1-3-12-5-9(8)17-11/h7,12H,1-6H2,(H,13,14,15)
InChIKeyYKALCDGOVANHQP-UHFFFAOYSA-N
MW253.33 g/mol
LogP0.76
Rot. Bonds2

About N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide

N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide (PubChem CID 61272434) has the molecular formula C11H15N3O2S and a molecular weight of 253.33 g/mol. Its IUPAC name is N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide
PubChem CID61272434
Molecular FormulaC11H15N3O2S
Molecular Weight253.33 g/mol
Exact Mass253.09
IUPAC NameN-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide
SMILESO=C(Nc1nc2c(s1)CNCC2)C1CCOC1
InChIInChI=1S/C11H15N3O2S/c15-10(7-2-4-16-6-7)14-11-13-8-1-3-12-5-9(8)17-11/h7,12H,1-6H2,(H,13,14,15)
InChIKeyYKALCDGOVANHQP-UHFFFAOYSA-N
XLogP0.76
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide?
The IUPAC name of N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide (CID 61272434) is N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide?
The canonical SMILES for N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide is O=C(Nc1nc2c(s1)CNCC2)C1CCOC1.
What is the InChIKey of N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide?
The InChIKey is YKALCDGOVANHQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2S/c15-10(7-2-4-16-6-7)14-11-13-8-1-3-12-5-9(8)17-11/h7,12H,1-6H2,(H,13,14,15).
What are the key properties of N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide?
N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide has a molecular weight of 253.33 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 61272434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).