4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide

C10H16N4O2S — CID 46994674

IUPAC4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide
SMILESO=C(Nc1nncs1)N1CCC(CCO)CC1
InChIInChI=1S/C10H16N4O2S/c15-6-3-8-1-4-14(5-2-8)10(16)12-9-13-11-7-17-9/h7-8,15H,1-6H2,(H,12,13,16)
InChIKeyRPINIWMNUZVQPA-UHFFFAOYSA-N
MW256.33 g/mol
LogP1.16
Rot. Bonds3

About 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide

4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide (PubChem CID 46994674) has the molecular formula C10H16N4O2S and a molecular weight of 256.33 g/mol. Its IUPAC name is 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide
PubChem CID46994674
Molecular FormulaC10H16N4O2S
Molecular Weight256.33 g/mol
Exact Mass256.10
IUPAC Name4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide
SMILESO=C(Nc1nncs1)N1CCC(CCO)CC1
InChIInChI=1S/C10H16N4O2S/c15-6-3-8-1-4-14(5-2-8)10(16)12-9-13-11-7-17-9/h7-8,15H,1-6H2,(H,12,13,16)
InChIKeyRPINIWMNUZVQPA-UHFFFAOYSA-N
XLogP1.16
TPSA78.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide (CID 46994674) is 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide is O=C(Nc1nncs1)N1CCC(CCO)CC1.
What is the InChIKey of 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide?
The InChIKey is RPINIWMNUZVQPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2S/c15-6-3-8-1-4-14(5-2-8)10(16)12-9-13-11-7-17-9/h7-8,15H,1-6H2,(H,12,13,16).
What are the key properties of 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide?
4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide has a molecular weight of 256.33 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyethyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 46994674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).