N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide

C13H16N4OS — CID 166605852

IUPACN-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2nc3cnccc3s2)C1
InChIInChI=1S/C13H16N4OS/c1-14-12(18)9-3-2-6-17(8-9)13-16-10-7-15-5-4-11(10)19-13/h4-5,7,9H,2-3,6,8H2,1H3,(H,14,18)
InChIKeyWSKDZPLETOXAKP-UHFFFAOYSA-N
MW276.36 g/mol
LogP1.65
Rot. Bonds2

About N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide

N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide (PubChem CID 166605852) has the molecular formula C13H16N4OS and a molecular weight of 276.36 g/mol. Its IUPAC name is N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide
PubChem CID166605852
Molecular FormulaC13H16N4OS
Molecular Weight276.36 g/mol
Exact Mass276.10
IUPAC NameN-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2nc3cnccc3s2)C1
InChIInChI=1S/C13H16N4OS/c1-14-12(18)9-3-2-6-17(8-9)13-16-10-7-15-5-4-11(10)19-13/h4-5,7,9H,2-3,6,8H2,1H3,(H,14,18)
InChIKeyWSKDZPLETOXAKP-UHFFFAOYSA-N
XLogP1.65
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide (CID 166605852) is N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide is CNC(=O)C1CCCN(c2nc3cnccc3s2)C1.
What is the InChIKey of N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide?
The InChIKey is WSKDZPLETOXAKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4OS/c1-14-12(18)9-3-2-6-17(8-9)13-16-10-7-15-5-4-11(10)19-13/h4-5,7,9H,2-3,6,8H2,1H3,(H,14,18).
What are the key properties of N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide?
N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 166605852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).