1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine

C11H13N5S2 — CID 72877150

IUPAC1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine
SMILESCc1nn(C)c2nc(NC(C)c3nccs3)sc12
InChIInChI=1S/C11H13N5S2/c1-6-8-9(16(3)15-6)14-11(18-8)13-7(2)10-12-4-5-17-10/h4-5,7H,1-3H3,(H,13,14)
InChIKeyXOXSEGPXJQEPHJ-UHFFFAOYSA-N
MW279.39 g/mol
LogP2.97
Rot. Bonds3

About 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine

1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine (PubChem CID 72877150) has the molecular formula C11H13N5S2 and a molecular weight of 279.39 g/mol. Its IUPAC name is 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine.

Molecular Properties

Compound Name1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine
PubChem CID72877150
Molecular FormulaC11H13N5S2
Molecular Weight279.39 g/mol
Exact Mass279.06
IUPAC Name1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine
SMILESCc1nn(C)c2nc(NC(C)c3nccs3)sc12
InChIInChI=1S/C11H13N5S2/c1-6-8-9(16(3)15-6)14-11(18-8)13-7(2)10-12-4-5-17-10/h4-5,7H,1-3H3,(H,13,14)
InChIKeyXOXSEGPXJQEPHJ-UHFFFAOYSA-N
XLogP2.97
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine with MolForge

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Related Compounds

N-[(1S)-1-(5-amino-1,3,4-thiadiazol-2-yl)ethyl]-1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-amine
CID 97453235
1,3-dimethyl-N-[(1S)-1-(6-methyl-3-pyridinyl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine
CID 97270175
N-[1-(1,3-thiazol-2-yl)ethyl]-1,3-thiazol-2-amine
CID 63612751
1,3-dimethyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]pyrazolo[5,4-d][1,3]thiazol-5-amine
CID 97270342
4-chloro-2-[1-(1,3-thiazol-2-yl)ethylamino]-1,3-thiazole-5-carbonitrile
CID 106595609
N-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]-1-(1,3-thiazol-2-yl)ethanamine
CID 115906881
N,1,3-trimethyl-N-(1,3-thiazol-2-ylmethyl)pyrazolo[5,4-d][1,3]thiazol-5-amine
CID 72920681
1,3-dimethyl-N-[(1R)-1-(5-methyl-2-pyridinyl)propyl]pyrazolo[5,4-d][1,3]thiazol-5-amine
CID 97453339
6-hydrazinyl-2-methyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 80917620
N-[1-(1,3-thiazol-2-yl)ethyl]propan-2-amine
CID 46785150
N-[1-(1,3-thiazol-2-yl)ethyl]-2-(1,2,4-triazol-1-yl)aniline
CID 64993427
4,6-dimethyl-2-[1-(1,3-thiazol-2-yl)ethylamino]pyridine-3-carbonitrile
CID 63612589

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine?
The IUPAC name of 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine (CID 72877150) is 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine.
What is the SMILES notation for 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine?
The canonical SMILES for 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine is Cc1nn(C)c2nc(NC(C)c3nccs3)sc12.
What is the InChIKey of 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine?
The InChIKey is XOXSEGPXJQEPHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5S2/c1-6-8-9(16(3)15-6)14-11(18-8)13-7(2)10-12-4-5-17-10/h4-5,7H,1-3H3,(H,13,14).
What are the key properties of 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine?
1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine has a molecular weight of 279.39 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[5,4-d][1,3]thiazol-5-amine is sourced from PubChem (CID 72877150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).