1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone

C10H16N4OS — CID 115587343

IUPAC1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone
SMILESO=C(CNCc1csnn1)N1CCCCC1
InChIInChI=1S/C10H16N4OS/c15-10(14-4-2-1-3-5-14)7-11-6-9-8-16-13-12-9/h8,11H,1-7H2
InChIKeyOUGONIHEEPQVEO-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.64
Rot. Bonds4

About 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone

1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone (PubChem CID 115587343) has the molecular formula C10H16N4OS and a molecular weight of 240.33 g/mol. Its IUPAC name is 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone.

Molecular Properties

Compound Name1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone
PubChem CID115587343
Molecular FormulaC10H16N4OS
Molecular Weight240.33 g/mol
Exact Mass240.10
IUPAC Name1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone
SMILESO=C(CNCc1csnn1)N1CCCCC1
InChIInChI=1S/C10H16N4OS/c15-10(14-4-2-1-3-5-14)7-11-6-9-8-16-13-12-9/h8,11H,1-7H2
InChIKeyOUGONIHEEPQVEO-UHFFFAOYSA-N
XLogP0.64
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone?
The IUPAC name of 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone (CID 115587343) is 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone.
What is the SMILES notation for 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone?
The canonical SMILES for 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone is O=C(CNCc1csnn1)N1CCCCC1.
What is the InChIKey of 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone?
The InChIKey is OUGONIHEEPQVEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4OS/c15-10(14-4-2-1-3-5-14)7-11-6-9-8-16-13-12-9/h8,11H,1-7H2.
What are the key properties of 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone?
1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone has a molecular weight of 240.33 g/mol, XLogP of 0.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-yl-2-(thiadiazol-4-ylmethylamino)ethanone is sourced from PubChem (CID 115587343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).