N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide

C15H20N4O2S2 — CID 29413355

IUPACN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
SMILESCCN1CCc2nc(NC(=O)CCn3c(C)csc3=O)sc2C1
InChIInChI=1S/C15H20N4O2S2/c1-3-18-6-4-11-12(8-18)23-14(16-11)17-13(20)5-7-19-10(2)9-22-15(19)21/h9H,3-8H2,1-2H3,(H,16,17,20)
InChIKeyDVISWNQXRKPLQF-UHFFFAOYSA-N
MW352.49 g/mol
LogP2.08
Rot. Bonds5

About N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide

N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide (PubChem CID 29413355) has the molecular formula C15H20N4O2S2 and a molecular weight of 352.49 g/mol. Its IUPAC name is N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide.

Molecular Properties

Compound NameN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
PubChem CID29413355
Molecular FormulaC15H20N4O2S2
Molecular Weight352.49 g/mol
Exact Mass352.10
IUPAC NameN-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
SMILESCCN1CCc2nc(NC(=O)CCn3c(C)csc3=O)sc2C1
InChIInChI=1S/C15H20N4O2S2/c1-3-18-6-4-11-12(8-18)23-14(16-11)17-13(20)5-7-19-10(2)9-22-15(19)21/h9H,3-8H2,1-2H3,(H,16,17,20)
InChIKeyDVISWNQXRKPLQF-UHFFFAOYSA-N
XLogP2.08
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.49
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The IUPAC name of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide (CID 29413355) is N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide.
What is the SMILES notation for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The canonical SMILES for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide is CCN1CCc2nc(NC(=O)CCn3c(C)csc3=O)sc2C1.
What is the InChIKey of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The InChIKey is DVISWNQXRKPLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2S2/c1-3-18-6-4-11-12(8-18)23-14(16-11)17-13(20)5-7-19-10(2)9-22-15(19)21/h9H,3-8H2,1-2H3,(H,16,17,20).
What are the key properties of N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide has a molecular weight of 352.49 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide is sourced from PubChem (CID 29413355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).