[2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine

C10H15N5S — CID 114352150

IUPAC[2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine
SMILESCc1nnc2sc(C3CCCC3CN)nn12
InChIInChI=1S/C10H15N5S/c1-6-12-13-10-15(6)14-9(16-10)8-4-2-3-7(8)5-11/h7-8H,2-5,11H2,1H3
InChIKeyFZKVCKBVBJPOIM-UHFFFAOYSA-N
MW237.33 g/mol
LogP1.34
Rot. Bonds2

About [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine

[2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine (PubChem CID 114352150) has the molecular formula C10H15N5S and a molecular weight of 237.33 g/mol. Its IUPAC name is [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine.

Molecular Properties

Compound Name[2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine
PubChem CID114352150
Molecular FormulaC10H15N5S
Molecular Weight237.33 g/mol
Exact Mass237.10
IUPAC Name[2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine
SMILESCc1nnc2sc(C3CCCC3CN)nn12
InChIInChI=1S/C10H15N5S/c1-6-12-13-10-15(6)14-9(16-10)8-4-2-3-7(8)5-11/h7-8H,2-5,11H2,1H3
InChIKeyFZKVCKBVBJPOIM-UHFFFAOYSA-N
XLogP1.34
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[2-[3-(oxolan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclopentyl]methanamine
CID 114353961
2,3,3-trimethyl-4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclohexan-1-amine
CID 102629487
3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentane-1-carboxylic acid
CID 103551589
(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)methanamine
CID 28812162
N-[3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclohexyl]acetamide
CID 24870599
2-(3-cyclopropyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclohexan-1-amine
CID 114354491
1-[4-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)piperidin-1-yl]propan-1-one
CID 110405231
2-(3-cyclopentyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cycloheptan-1-amine
CID 114355508
2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)ethanamine
CID 28812164
2-amino-2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)propan-1-ol
CID 130624041
6-(2,3-dihydro-1H-indol-2-yl)-3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
CID 114351952
2-methyl-2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclohexan-1-amine
CID 114352026

Frequently Asked Questions

What is the IUPAC name of [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine?
The IUPAC name of [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine (CID 114352150) is [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine.
What is the SMILES notation for [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine?
The canonical SMILES for [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine is Cc1nnc2sc(C3CCCC3CN)nn12.
What is the InChIKey of [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine?
The InChIKey is FZKVCKBVBJPOIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5S/c1-6-12-13-10-15(6)14-9(16-10)8-4-2-3-7(8)5-11/h7-8H,2-5,11H2,1H3.
What are the key properties of [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine?
[2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine has a molecular weight of 237.33 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)cyclopentyl]methanamine is sourced from PubChem (CID 114352150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).