(3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

C10H16N4OS — CID 107641885

IUPAC(3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
SMILESCCc1nnc(NC(=O)[C@@H]2CCCNC2)s1
InChIInChI=1S/C10H16N4OS/c1-2-8-13-14-10(16-8)12-9(15)7-4-3-5-11-6-7/h7,11H,2-6H2,1H3,(H,12,14,15)/t7-/m1/s1
InChIKeySOLBJRSFZAOYMH-SSDOTTSWSA-N
MW240.33 g/mol
LogP1.04
Rot. Bonds3

About (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

(3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide (PubChem CID 107641885) has the molecular formula C10H16N4OS and a molecular weight of 240.33 g/mol. Its IUPAC name is (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
PubChem CID107641885
Molecular FormulaC10H16N4OS
Molecular Weight240.33 g/mol
Exact Mass240.10
IUPAC Name(3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
SMILESCCc1nnc(NC(=O)[C@@H]2CCCNC2)s1
InChIInChI=1S/C10H16N4OS/c1-2-8-13-14-10(16-8)12-9(15)7-4-3-5-11-6-7/h7,11H,2-6H2,1H3,(H,12,14,15)/t7-/m1/s1
InChIKeySOLBJRSFZAOYMH-SSDOTTSWSA-N
XLogP1.04
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide (CID 107641885) is (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide is CCc1nnc(NC(=O)[C@@H]2CCCNC2)s1.
What is the InChIKey of (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide?
The InChIKey is SOLBJRSFZAOYMH-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H16N4OS/c1-2-8-13-14-10(16-8)12-9(15)7-4-3-5-11-6-7/h7,11H,2-6H2,1H3,(H,12,14,15)/t7-/m1/s1.
What are the key properties of (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide?
(3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide has a molecular weight of 240.33 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 107641885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).