piperidine-4-carboxamide;trihydrochloride

C6H15Cl3N2O — CID 141114926

IUPACpiperidine-4-carboxamide;trihydrochloride
SMILESCl.Cl.Cl.NC(=O)C1CCNCC1
InChIInChI=1S/C6H12N2O.3ClH/c7-6(9)5-1-3-8-4-2-5;;;/h5,8H,1-4H2,(H2,7,9);3*1H
InChIKeyMECMQUIFXPVQKX-UHFFFAOYSA-N
MW237.56 g/mol
LogP0.74
Rot. Bonds1

About piperidine-4-carboxamide;trihydrochloride

piperidine-4-carboxamide;trihydrochloride (PubChem CID 141114926) has the molecular formula C6H15Cl3N2O and a molecular weight of 237.56 g/mol. Its IUPAC name is piperidine-4-carboxamide;trihydrochloride.

Molecular Properties

Compound Namepiperidine-4-carboxamide;trihydrochloride
PubChem CID141114926
Molecular FormulaC6H15Cl3N2O
Molecular Weight237.56 g/mol
Exact Mass236.02
IUPAC Namepiperidine-4-carboxamide;trihydrochloride
SMILESCl.Cl.Cl.NC(=O)C1CCNCC1
InChIInChI=1S/C6H12N2O.3ClH/c7-6(9)5-1-3-8-4-2-5;;;/h5,8H,1-4H2,(H2,7,9);3*1H
InChIKeyMECMQUIFXPVQKX-UHFFFAOYSA-N
XLogP0.74
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.56
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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1-piperidin-4-ylazetidine-3-carboxamide;dihydrochloride
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4-aminocyclohexane-1-carboxamide;dihydrochloride
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methyl piperidine-4-carboxylate;hydrochloride
CID 18783829
2-oxo-2-piperidin-4-ylacetyl fluoride
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14,17-dipentyl-azacycloicosane-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of piperidine-4-carboxamide;trihydrochloride?
The IUPAC name of piperidine-4-carboxamide;trihydrochloride (CID 141114926) is piperidine-4-carboxamide;trihydrochloride.
What is the SMILES notation for piperidine-4-carboxamide;trihydrochloride?
The canonical SMILES for piperidine-4-carboxamide;trihydrochloride is Cl.Cl.Cl.NC(=O)C1CCNCC1.
What is the InChIKey of piperidine-4-carboxamide;trihydrochloride?
The InChIKey is MECMQUIFXPVQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.3ClH/c7-6(9)5-1-3-8-4-2-5;;;/h5,8H,1-4H2,(H2,7,9);3*1H.
What are the key properties of piperidine-4-carboxamide;trihydrochloride?
piperidine-4-carboxamide;trihydrochloride has a molecular weight of 237.56 g/mol, XLogP of 0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-4-carboxamide;trihydrochloride is sourced from PubChem (CID 141114926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).