N-piperidin-4-yloxane-4-carboxamide;hydrochloride

C11H21ClN2O2 — CID 53255847

IUPACN-piperidin-4-yloxane-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCNCC1)C1CCOCC1
InChIInChI=1S/C11H20N2O2.ClH/c14-11(9-3-7-15-8-4-9)13-10-1-5-12-6-2-10;/h9-10,12H,1-8H2,(H,13,14);1H
InChIKeyKMFYSOXSUOHEEJ-UHFFFAOYSA-N
MW248.75 g/mol
LogP0.70
Rot. Bonds2

About N-piperidin-4-yloxane-4-carboxamide;hydrochloride

N-piperidin-4-yloxane-4-carboxamide;hydrochloride (PubChem CID 53255847) has the molecular formula C11H21ClN2O2 and a molecular weight of 248.75 g/mol. Its IUPAC name is N-piperidin-4-yloxane-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-4-yloxane-4-carboxamide;hydrochloride
PubChem CID53255847
Molecular FormulaC11H21ClN2O2
Molecular Weight248.75 g/mol
Exact Mass248.13
IUPAC NameN-piperidin-4-yloxane-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCNCC1)C1CCOCC1
InChIInChI=1S/C11H20N2O2.ClH/c14-11(9-3-7-15-8-4-9)13-10-1-5-12-6-2-10;/h9-10,12H,1-8H2,(H,13,14);1H
InChIKeyKMFYSOXSUOHEEJ-UHFFFAOYSA-N
XLogP0.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.75
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yloxane-4-carboxamide;hydrochloride?
The IUPAC name of N-piperidin-4-yloxane-4-carboxamide;hydrochloride (CID 53255847) is N-piperidin-4-yloxane-4-carboxamide;hydrochloride.
What is the SMILES notation for N-piperidin-4-yloxane-4-carboxamide;hydrochloride?
The canonical SMILES for N-piperidin-4-yloxane-4-carboxamide;hydrochloride is Cl.O=C(NC1CCNCC1)C1CCOCC1.
What is the InChIKey of N-piperidin-4-yloxane-4-carboxamide;hydrochloride?
The InChIKey is KMFYSOXSUOHEEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2.ClH/c14-11(9-3-7-15-8-4-9)13-10-1-5-12-6-2-10;/h9-10,12H,1-8H2,(H,13,14);1H.
What are the key properties of N-piperidin-4-yloxane-4-carboxamide;hydrochloride?
N-piperidin-4-yloxane-4-carboxamide;hydrochloride has a molecular weight of 248.75 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yloxane-4-carboxamide;hydrochloride is sourced from PubChem (CID 53255847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).