3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide

C11H17N5OS — CID 75520974

IUPAC3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide
SMILESNC(=O)N1CCCC(Nc2nc(C3CC3)ns2)C1
InChIInChI=1S/C11H17N5OS/c12-10(17)16-5-1-2-8(6-16)13-11-14-9(15-18-11)7-3-4-7/h7-8H,1-6H2,(H2,12,17)(H,13,14,15)
InChIKeyADQSHZLWDXPGIL-UHFFFAOYSA-N
MW267.36 g/mol
LogP1.37
Rot. Bonds3

About 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide

3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide (PubChem CID 75520974) has the molecular formula C11H17N5OS and a molecular weight of 267.36 g/mol. Its IUPAC name is 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide
PubChem CID75520974
Molecular FormulaC11H17N5OS
Molecular Weight267.36 g/mol
Exact Mass267.12
IUPAC Name3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide
SMILESNC(=O)N1CCCC(Nc2nc(C3CC3)ns2)C1
InChIInChI=1S/C11H17N5OS/c12-10(17)16-5-1-2-8(6-16)13-11-14-9(15-18-11)7-3-4-7/h7-8H,1-6H2,(H2,12,17)(H,13,14,15)
InChIKeyADQSHZLWDXPGIL-UHFFFAOYSA-N
XLogP1.37
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.36
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide?
The IUPAC name of 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide (CID 75520974) is 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide.
What is the SMILES notation for 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide?
The canonical SMILES for 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide is NC(=O)N1CCCC(Nc2nc(C3CC3)ns2)C1.
What is the InChIKey of 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide?
The InChIKey is ADQSHZLWDXPGIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5OS/c12-10(17)16-5-1-2-8(6-16)13-11-14-9(15-18-11)7-3-4-7/h7-8H,1-6H2,(H2,12,17)(H,13,14,15).
What are the key properties of 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide?
3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide has a molecular weight of 267.36 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 75520974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).