1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol

C11H14N4OS2 — CID 103349385

IUPAC1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol
SMILESCc1csc(-c2c(N)nsc2N2CCC(O)C2)n1
InChIInChI=1S/C11H14N4OS2/c1-6-5-17-10(13-6)8-9(12)14-18-11(8)15-3-2-7(16)4-15/h5,7,16H,2-4H2,1H3,(H2,12,14)
InChIKeyOYQCLIVJVGPRCW-UHFFFAOYSA-N
MW282.39 g/mol
LogP1.73
Rot. Bonds2

About 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol

1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol (PubChem CID 103349385) has the molecular formula C11H14N4OS2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol.

Molecular Properties

Compound Name1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol
PubChem CID103349385
Molecular FormulaC11H14N4OS2
Molecular Weight282.39 g/mol
Exact Mass282.06
IUPAC Name1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol
SMILESCc1csc(-c2c(N)nsc2N2CCC(O)C2)n1
InChIInChI=1S/C11H14N4OS2/c1-6-5-17-10(13-6)8-9(12)14-18-11(8)15-3-2-7(16)4-15/h5,7,16H,2-4H2,1H3,(H2,12,14)
InChIKeyOYQCLIVJVGPRCW-UHFFFAOYSA-N
XLogP1.73
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]-4-methylpiperidin-3-ol
CID 103349878
5-(4-ethyl-4-methylpiperidin-1-yl)-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-3-amine
CID 103349401
4-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]-1,4-diazepan-2-one
CID 103349465
5-N-(1-cyclopropylpyrrolidin-3-yl)-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazole-3,5-diamine
CID 103349002
[1-[3-amino-4-(2-methyl-1,3-thiazol-4-yl)-1,2-thiazol-5-yl]pyrrolidin-3-yl]methanol
CID 103383882
1-(3-amino-4-pyridin-3-yl-1,2-thiazol-5-yl)piperidin-3-ol
CID 103361611
5-N-(3-methylcyclopentyl)-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazole-3,5-diamine
CID 103349818
5-N-(cyclohexylmethyl)-5-N-methyl-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazole-3,5-diamine
CID 103349244
4-(2-methyl-1,3-thiazol-4-yl)-5-(4-propan-2-ylpiperidin-1-yl)-1,2-thiazol-3-amine
CID 103505421
1-[3-amino-4-(2-methyl-1,3-thiazol-4-yl)-1,2-thiazol-5-yl]piperidine-3-carboxamide
CID 103381037
5-N-[(4-methylmorpholin-2-yl)methyl]-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazole-3,5-diamine
CID 103348830
1-(3-amino-4-propan-2-yloxy-1,2-thiazol-5-yl)piperidin-3-ol
CID 103361617

Frequently Asked Questions

What is the IUPAC name of 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol?
The IUPAC name of 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol (CID 103349385) is 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol.
What is the SMILES notation for 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol?
The canonical SMILES for 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol is Cc1csc(-c2c(N)nsc2N2CCC(O)C2)n1.
What is the InChIKey of 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol?
The InChIKey is OYQCLIVJVGPRCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS2/c1-6-5-17-10(13-6)8-9(12)14-18-11(8)15-3-2-7(16)4-15/h5,7,16H,2-4H2,1H3,(H2,12,14).
What are the key properties of 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol?
1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol has a molecular weight of 282.39 g/mol, XLogP of 1.73, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-amino-4-(4-methyl-1,3-thiazol-2-yl)-1,2-thiazol-5-yl]pyrrolidin-3-ol is sourced from PubChem (CID 103349385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).