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

C14H17N5O2S2 — CID 90525280

IUPAC2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)Nc1nc2c(s1)CN(CC(=O)Nc1nc(C)cs1)CC2
InChIInChI=1S/C14H17N5O2S2/c1-8-7-22-13(15-8)18-12(21)6-19-4-3-10-11(5-19)23-14(17-10)16-9(2)20/h7H,3-6H2,1-2H3,(H,15,18,21)(H,16,17,20)
InChIKeyMLLVIYUJXWJWFN-UHFFFAOYSA-N
MW351.46 g/mol
LogP1.86
Rot. Bonds4

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

2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 90525280) has the molecular formula C14H17N5O2S2 and a molecular weight of 351.46 g/mol. Its IUPAC name is 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID90525280
Molecular FormulaC14H17N5O2S2
Molecular Weight351.46 g/mol
Exact Mass351.08
IUPAC Name2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)Nc1nc2c(s1)CN(CC(=O)Nc1nc(C)cs1)CC2
InChIInChI=1S/C14H17N5O2S2/c1-8-7-22-13(15-8)18-12(21)6-19-4-3-10-11(5-19)23-14(17-10)16-9(2)20/h7H,3-6H2,1-2H3,(H,15,18,21)(H,16,17,20)
InChIKeyMLLVIYUJXWJWFN-UHFFFAOYSA-N
XLogP1.86
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.46
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

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Related Compounds

2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-ethylacetamide
CID 90525295
2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide
CID 90525284
2-[4-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]piperazin-1-yl]acetic acid
CID 43521752
N-[5-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]thiophene-3-carboxamide
CID 90532142
methyl N-[5-[2-(4-acetylanilino)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]carbamate
CID 90529041
N-(4-methyl-1,3-thiazol-2-yl)-2-(4-oxo-2-piperidin-1-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-6-yl)acetamide
CID 135719833
N-[5-[2-(4-methylanilino)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]thiophene-3-carboxamide
CID 90532137
N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-methylphenyl)propanamide
CID 29413371
ethyl N-[5-[2-(naphthalen-1-ylamino)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]carbamate
CID 90528017
ethyl N-[5-[2-(2-fluoroanilino)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]carbamate
CID 90528028
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 63596576
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-morpholin-4-ylacetamide
CID 110444203

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide (CID 90525280) is 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide is CC(=O)Nc1nc2c(s1)CN(CC(=O)Nc1nc(C)cs1)CC2.
What is the InChIKey of 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is MLLVIYUJXWJWFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2S2/c1-8-7-22-13(15-8)18-12(21)6-19-4-3-10-11(5-19)23-14(17-10)16-9(2)20/h7H,3-6H2,1-2H3,(H,15,18,21)(H,16,17,20).
What are the key properties of 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 351.46 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 90525280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).