N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride

C9H15ClN4OS — CID 120567282

IUPACN-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride
SMILESCC1(NC(=O)c2cnns2)CCNCC1.Cl
InChIInChI=1S/C9H14N4OS.ClH/c1-9(2-4-10-5-3-9)12-8(14)7-6-11-13-15-7;/h6,10H,2-5H2,1H3,(H,12,14);1H
InChIKeyRYNRHMOJVMUHCD-UHFFFAOYSA-N
MW262.77 g/mol
LogP0.83
Rot. Bonds2

About N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride

N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride (PubChem CID 120567282) has the molecular formula C9H15ClN4OS and a molecular weight of 262.77 g/mol. Its IUPAC name is N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride
PubChem CID120567282
Molecular FormulaC9H15ClN4OS
Molecular Weight262.77 g/mol
Exact Mass262.07
IUPAC NameN-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride
SMILESCC1(NC(=O)c2cnns2)CCNCC1.Cl
InChIInChI=1S/C9H14N4OS.ClH/c1-9(2-4-10-5-3-9)12-8(14)7-6-11-13-15-7;/h6,10H,2-5H2,1H3,(H,12,14);1H
InChIKeyRYNRHMOJVMUHCD-UHFFFAOYSA-N
XLogP0.83
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.77
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride?
The IUPAC name of N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride (CID 120567282) is N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride?
The canonical SMILES for N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride is CC1(NC(=O)c2cnns2)CCNCC1.Cl.
What is the InChIKey of N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride?
The InChIKey is RYNRHMOJVMUHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4OS.ClH/c1-9(2-4-10-5-3-9)12-8(14)7-6-11-13-15-7;/h6,10H,2-5H2,1H3,(H,12,14);1H.
What are the key properties of N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride?
N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride has a molecular weight of 262.77 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperidin-4-yl)thiadiazole-5-carboxamide;hydrochloride is sourced from PubChem (CID 120567282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).