N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine

C8H14N4S — CID 65276095

IUPACN-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
SMILESc1nsc(NCC2CCCCN2)n1
InChIInChI=1S/C8H14N4S/c1-2-4-9-7(3-1)5-10-8-11-6-12-13-8/h6-7,9H,1-5H2,(H,10,11,12)
InChIKeyQNXUJCSUQASPRW-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.09
Rot. Bonds3

About N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine

N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine (PubChem CID 65276095) has the molecular formula C8H14N4S and a molecular weight of 198.29 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
PubChem CID65276095
Molecular FormulaC8H14N4S
Molecular Weight198.29 g/mol
Exact Mass198.09
IUPAC NameN-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
SMILESc1nsc(NCC2CCCCN2)n1
InChIInChI=1S/C8H14N4S/c1-2-4-9-7(3-1)5-10-8-11-6-12-13-8/h6-7,9H,1-5H2,(H,10,11,12)
InChIKeyQNXUJCSUQASPRW-UHFFFAOYSA-N
XLogP1.09
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 106641188
6-chloro-N-(piperidin-2-ylmethyl)pyrimidin-4-amine
CID 71639840
5-chloro-2-fluoro-4-(2-piperidin-2-ylethylamino)-N-(1,2,4-thiadiazol-5-yl)benzenesulfonamide
CID 134477090
4,6-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine;hydrochloride
CID 71638393
N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine
CID 106642542
2,4,6-trichloro-N-(piperidin-2-ylmethyl)aniline
CID 106633086
N-(piperidin-2-ylmethyl)cyclooctanamine
CID 106632850
4-[(1,2,4-thiadiazol-5-ylamino)methyl]pyrrolidin-2-one
CID 130944205
5-cyclohexyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 116974804
1-methyl-3-(piperidin-2-ylmethylamino)pyrazin-2-one
CID 62939407
4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
CID 83838031
N-(piperidin-2-ylmethyl)-1-propan-2-ylimidazol-2-amine
CID 115033626

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine (CID 65276095) is N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine is c1nsc(NCC2CCCCN2)n1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine?
The InChIKey is QNXUJCSUQASPRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4S/c1-2-4-9-7(3-1)5-10-8-11-6-12-13-8/h6-7,9H,1-5H2,(H,10,11,12).
What are the key properties of N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine?
N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine has a molecular weight of 198.29 g/mol, XLogP of 1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65276095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).