N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine

C10H18N4S — CID 65275575

IUPACN-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine
SMILESCCCN(c1ncns1)C1CCCNC1
InChIInChI=1S/C10H18N4S/c1-2-6-14(10-12-8-13-15-10)9-4-3-5-11-7-9/h8-9,11H,2-7H2,1H3
InChIKeyNJOQUOIBNGDLEH-UHFFFAOYSA-N
MW226.35 g/mol
LogP1.51
Rot. Bonds4

About N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine

N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine (PubChem CID 65275575) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine
PubChem CID65275575
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC NameN-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine
SMILESCCCN(c1ncns1)C1CCCNC1
InChIInChI=1S/C10H18N4S/c1-2-6-14(10-12-8-13-15-10)9-4-3-5-11-7-9/h8-9,11H,2-7H2,1H3
InChIKeyNJOQUOIBNGDLEH-UHFFFAOYSA-N
XLogP1.51
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine (CID 65275575) is N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine is CCCN(c1ncns1)C1CCCNC1.
What is the InChIKey of N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine?
The InChIKey is NJOQUOIBNGDLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-2-6-14(10-12-8-13-15-10)9-4-3-5-11-7-9/h8-9,11H,2-7H2,1H3.
What are the key properties of N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine?
N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine has a molecular weight of 226.35 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-N-propyl-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65275575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).