3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine

C14H24N4S — CID 65271588

IUPAC3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine
SMILESCC(CNc1nc(C2CC2)ns1)CN1CCCCC1
InChIInChI=1S/C14H24N4S/c1-11(10-18-7-3-2-4-8-18)9-15-14-16-13(17-19-14)12-5-6-12/h11-12H,2-10H2,1H3,(H,15,16,17)
InChIKeyMWHGVNZGTNRRPK-UHFFFAOYSA-N
MW280.44 g/mol
LogP2.95
Rot. Bonds6

About 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine

3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine (PubChem CID 65271588) has the molecular formula C14H24N4S and a molecular weight of 280.44 g/mol. Its IUPAC name is 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine
PubChem CID65271588
Molecular FormulaC14H24N4S
Molecular Weight280.44 g/mol
Exact Mass280.17
IUPAC Name3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine
SMILESCC(CNc1nc(C2CC2)ns1)CN1CCCCC1
InChIInChI=1S/C14H24N4S/c1-11(10-18-7-3-2-4-8-18)9-15-14-16-13(17-19-14)12-5-6-12/h11-12H,2-10H2,1H3,(H,15,16,17)
InChIKeyMWHGVNZGTNRRPK-UHFFFAOYSA-N
XLogP2.95
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine
CID 65268166
1-N-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)propane-1,2-diamine
CID 65275684
1-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]-3-morpholin-4-ylpropan-2-ol
CID 133383166
3-cyclopropyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-1,2,4-thiadiazol-5-amine
CID 65276766
3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]-2-methylpropanoic acid
CID 65270826
4,5-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-thiazol-2-amine
CID 65169907
6-chloro-2-cyclopropyl-5-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
CID 80971665
1-cyclopropyl-2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]ethanol
CID 65274384
N-(2-chloro-2-cyclopropylethyl)-3-cyclopropyl-1,2,4-thiadiazol-5-amine
CID 65277411
1-[2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]ethylamino]propan-2-ol
CID 104594431
3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-N-(2-methylpropyl)-1,2,4-thiadiazol-5-amine
CID 112681785
3-cycloheptyl-N-propan-2-yl-1,2,4-thiadiazol-5-amine
CID 65423064

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine (CID 65271588) is 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine is CC(CNc1nc(C2CC2)ns1)CN1CCCCC1.
What is the InChIKey of 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine?
The InChIKey is MWHGVNZGTNRRPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4S/c1-11(10-18-7-3-2-4-8-18)9-15-14-16-13(17-19-14)12-5-6-12/h11-12H,2-10H2,1H3,(H,15,16,17).
What are the key properties of 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine?
3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine has a molecular weight of 280.44 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65271588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).