5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine

C9H17N5S — CID 66281219

IUPAC5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine
SMILESCN(C)C1CCCN(c2nc(N)ns2)C1
InChIInChI=1S/C9H17N5S/c1-13(2)7-4-3-5-14(6-7)9-11-8(10)12-15-9/h7H,3-6H2,1-2H3,(H2,10,12)
InChIKeyUHGSGWSCSFWHFK-UHFFFAOYSA-N
MW227.34 g/mol
LogP0.65
Rot. Bonds2

About 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine

5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine (PubChem CID 66281219) has the molecular formula C9H17N5S and a molecular weight of 227.34 g/mol. Its IUPAC name is 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine.

Molecular Properties

Compound Name5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine
PubChem CID66281219
Molecular FormulaC9H17N5S
Molecular Weight227.34 g/mol
Exact Mass227.12
IUPAC Name5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine
SMILESCN(C)C1CCCN(c2nc(N)ns2)C1
InChIInChI=1S/C9H17N5S/c1-13(2)7-4-3-5-14(6-7)9-11-8(10)12-15-9/h7H,3-6H2,1-2H3,(H2,10,12)
InChIKeyUHGSGWSCSFWHFK-UHFFFAOYSA-N
XLogP0.65
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.34
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(azocan-1-yl)-1,2,4-thiadiazol-3-amine
CID 66280784
1-(4-chloro-1,3-thiazol-2-yl)-N,N-dimethylpiperidin-3-amine
CID 83157211
1-(4-bromo-1,3-thiazol-2-yl)-N,N-dimethylpiperidin-3-amine
CID 79398821
4-[3-(dimethylamino)piperidin-1-yl]pyrimidin-2-amine
CID 80856327
4-[3-(dimethylamino)piperidin-1-yl]-6-methoxypyrimidin-2-amine
CID 45184702
6-[3-(dimethylamino)piperidin-1-yl]-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
CID 80833498
5-(4,4-dimethylpiperidin-1-yl)-1,2,4-thiadiazol-3-amine
CID 66280995
N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide
CID 163351135
5-(4-methoxypiperidin-1-yl)-1,2,4-thiadiazol-3-amine
CID 66278144
methyl 3-amino-5-[3-(dimethylamino)piperidin-1-yl]-1,2-thiazole-4-carboxylate
CID 103382204
5-[3-(dimethylamino)pyrrolidin-1-yl]-1,2-thiazol-3-amine
CID 103362838
6-[3-(dimethylamino)piperidin-1-yl]pyrimidin-4-amine
CID 80856163

Frequently Asked Questions

What is the IUPAC name of 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine?
The IUPAC name of 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine (CID 66281219) is 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine.
What is the SMILES notation for 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine?
The canonical SMILES for 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine is CN(C)C1CCCN(c2nc(N)ns2)C1.
What is the InChIKey of 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine?
The InChIKey is UHGSGWSCSFWHFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5S/c1-13(2)7-4-3-5-14(6-7)9-11-8(10)12-15-9/h7H,3-6H2,1-2H3,(H2,10,12).
What are the key properties of 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine?
5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine has a molecular weight of 227.34 g/mol, XLogP of 0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(dimethylamino)piperidin-1-yl]-1,2,4-thiadiazol-3-amine is sourced from PubChem (CID 66281219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).