N-piperidin-4-ylthiatriazol-5-amine

C6H11N5S — CID 117044442

IUPACN-piperidin-4-ylthiatriazol-5-amine
SMILESC1CC(Nc2nnns2)CCN1
InChIInChI=1S/C6H11N5S/c1-3-7-4-2-5(1)8-6-9-10-11-12-6/h5,7H,1-4H2,(H,8,9,11)
InChIKeyDDFRJGAUAHOGJA-UHFFFAOYSA-N
MW185.26 g/mol
LogP0.10
Rot. Bonds2

About N-piperidin-4-ylthiatriazol-5-amine

N-piperidin-4-ylthiatriazol-5-amine (PubChem CID 117044442) has the molecular formula C6H11N5S and a molecular weight of 185.26 g/mol. Its IUPAC name is N-piperidin-4-ylthiatriazol-5-amine.

Molecular Properties

Compound NameN-piperidin-4-ylthiatriazol-5-amine
PubChem CID117044442
Molecular FormulaC6H11N5S
Molecular Weight185.26 g/mol
Exact Mass185.07
IUPAC NameN-piperidin-4-ylthiatriazol-5-amine
SMILESC1CC(Nc2nnns2)CCN1
InChIInChI=1S/C6H11N5S/c1-3-7-4-2-5(1)8-6-9-10-11-12-6/h5,7H,1-4H2,(H,8,9,11)
InChIKeyDDFRJGAUAHOGJA-UHFFFAOYSA-N
XLogP0.10
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.26
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2-methylpropyl)-N-piperidin-4-yl-1,3,4-thiadiazol-2-amine
CID 106260980
4-methyl-N-piperidin-4-yl-1,3-thiazol-2-amine
CID 24708198
4,7-dichloro-N-piperidin-4-yl-1,3-benzothiazol-2-amine
CID 82192099
N-piperidin-4-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 115016981
N-piperidin-4-yl-1,2-thiazol-4-amine
CID 164646465
2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride
CID 67373203
5-(2-fluorophenyl)-2-N-piperidin-4-yl-1,3-thiazole-2,4-diamine
CID 174514403
N-pyridazin-3-ylazepan-4-amine
CID 107173783
2-(azetidin-3-yl)-N-(thiatriazol-5-yl)acetamide
CID 114912417
3,5-dichloro-N-piperidin-4-ylpyridin-4-amine
CID 134359724
N-piperidin-4-yl-5-(trifluoromethyl)pyridin-2-amine;trihydrochloride
CID 86276661
N-piperidin-4-yl-6-(trifluoromethyl)pyridin-2-amine;trihydrochloride
CID 86277771

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-ylthiatriazol-5-amine?
The IUPAC name of N-piperidin-4-ylthiatriazol-5-amine (CID 117044442) is N-piperidin-4-ylthiatriazol-5-amine.
What is the SMILES notation for N-piperidin-4-ylthiatriazol-5-amine?
The canonical SMILES for N-piperidin-4-ylthiatriazol-5-amine is C1CC(Nc2nnns2)CCN1.
What is the InChIKey of N-piperidin-4-ylthiatriazol-5-amine?
The InChIKey is DDFRJGAUAHOGJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5S/c1-3-7-4-2-5(1)8-6-9-10-11-12-6/h5,7H,1-4H2,(H,8,9,11).
What are the key properties of N-piperidin-4-ylthiatriazol-5-amine?
N-piperidin-4-ylthiatriazol-5-amine has a molecular weight of 185.26 g/mol, XLogP of 0.10, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-ylthiatriazol-5-amine is sourced from PubChem (CID 117044442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).