N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride

C11H21ClN2O2 — CID 172899475

IUPACN-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCOCC1)C1CCNCC1
InChIInChI=1S/C11H20N2O2.ClH/c14-11(9-1-5-12-6-2-9)13-10-3-7-15-8-4-10;/h9-10,12H,1-8H2,(H,13,14);1H
InChIKeyMNACCTBNZQUBKI-UHFFFAOYSA-N
MW248.75 g/mol
LogP0.70
Rot. Bonds2

About N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride

N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride (PubChem CID 172899475) has the molecular formula C11H21ClN2O2 and a molecular weight of 248.75 g/mol. Its IUPAC name is N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride
PubChem CID172899475
Molecular FormulaC11H21ClN2O2
Molecular Weight248.75 g/mol
Exact Mass248.13
IUPAC NameN-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCOCC1)C1CCNCC1
InChIInChI=1S/C11H20N2O2.ClH/c14-11(9-1-5-12-6-2-9)13-10-3-7-15-8-4-10;/h9-10,12H,1-8H2,(H,13,14);1H
InChIKeyMNACCTBNZQUBKI-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

Analyze N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3S)-pyrrolidin-3-yl]oxane-4-carboxamide
CID 79688091
N-cycloheptylpiperidine-4-carboxamide;hydrochloride
CID 70702347
N-piperidin-4-ylcyclopropanecarboxamide
CID 1445166
N-(thian-4-yl)piperidine-4-carboxamide;hydrochloride
CID 119313224
N-[(3R)-pyrrolidin-3-yl]piperidine-4-carboxamide
CID 91470745
N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide;hydrochloride
CID 119339836
N-piperidin-4-ylcycloheptanecarboxamide
CID 62587546
N-[3-(piperidine-4-carbonylamino)cyclohexyl]piperidine-4-carboxamide
CID 171722600
N-piperidin-4-ylazetidine-3-carboxamide
CID 123647317
4-oxo-N-piperidin-4-ylcyclohexane-1-carboxamide
CID 112531105
N-(azepan-4-yl)cyclohexanecarboxamide
CID 105059767
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]piperidine-4-carboxamide
CID 43711892

Frequently Asked Questions

What is the IUPAC name of N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride (CID 172899475) is N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride is Cl.O=C(NC1CCOCC1)C1CCNCC1.
What is the InChIKey of N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is MNACCTBNZQUBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2.ClH/c14-11(9-1-5-12-6-2-9)13-10-3-7-15-8-4-10;/h9-10,12H,1-8H2,(H,13,14);1H.
What are the key properties of N-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride?
N-(oxan-4-yl)piperidine-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-(oxan-4-yl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 172899475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).