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

C14H22N4O2S — CID 90525284

IUPAC2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CN1CCc2nc(NC(C)=O)sc2C1
InChIInChI=1S/C14H22N4O2S/c1-4-18(5-2)13(20)9-17-7-6-11-12(8-17)21-14(16-11)15-10(3)19/h4-9H2,1-3H3,(H,15,16,19)
InChIKeyAMTSVOXZESMLMF-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.33
Rot. Bonds5

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

2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide (PubChem CID 90525284) has the molecular formula C14H22N4O2S and a molecular weight of 310.42 g/mol. Its IUPAC name is 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide.

Molecular Properties

Compound Name2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide
PubChem CID90525284
Molecular FormulaC14H22N4O2S
Molecular Weight310.42 g/mol
Exact Mass310.15
IUPAC Name2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CN1CCc2nc(NC(C)=O)sc2C1
InChIInChI=1S/C14H22N4O2S/c1-4-18(5-2)13(20)9-17-7-6-11-12(8-17)21-14(16-11)15-10(3)19/h4-9H2,1-3H3,(H,15,16,19)
InChIKeyAMTSVOXZESMLMF-UHFFFAOYSA-N
XLogP1.33
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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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-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 90525280
ethyl 2-[2-(methoxycarbonylamino)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl]acetate
CID 90529105
1,1-diethyl-3-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)urea
CID 47433636
methyl 4-[(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)methyl]benzoate
CID 90525321
N-(6-benzyl-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-2-yl)acetamide
CID 19985779
N-[5-[2-[di(propan-2-yl)amino]-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]pyrazine-2-carboxamide
CID 90527616
ethyl 4-[2-[2-(methoxycarbonylamino)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl]acetyl]piperazine-1-carboxylate
CID 90528996
(2R)-2-amino-N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)propanamide
CID 119828537
ethyl 2-[2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl]acetate
CID 90530579
ethyl N-[5-[2-(2-fluoroanilino)-2-oxoethyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]carbamate
CID 90528028
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

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,N-diethylacetamide?
The IUPAC name of 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide (CID 90525284) is 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide.
What is the SMILES notation for 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide?
The canonical SMILES for 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide is CCN(CC)C(=O)CN1CCc2nc(NC(C)=O)sc2C1.
What is the InChIKey of 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide?
The InChIKey is AMTSVOXZESMLMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2S/c1-4-18(5-2)13(20)9-17-7-6-11-12(8-17)21-14(16-11)15-10(3)19/h4-9H2,1-3H3,(H,15,16,19).
What are the key properties of 2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide?
2-(2-acetamido-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-N,N-diethylacetamide has a molecular weight of 310.42 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 5 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,N-diethylacetamide is sourced from PubChem (CID 90525284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).