N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride

C15H22ClFN2O — CID 119275393

IUPACN-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride
SMILESCC(c1ccc(F)cc1)N(C)C(=O)C1CCNCC1.Cl
InChIInChI=1S/C15H21FN2O.ClH/c1-11(12-3-5-14(16)6-4-12)18(2)15(19)13-7-9-17-10-8-13;/h3-6,11,13,17H,7-10H2,1-2H3;1H
InChIKeyZIEDHFYYLZMWQU-UHFFFAOYSA-N
MW300.81 g/mol
LogP2.77
Rot. Bonds3

About N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride

N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride (PubChem CID 119275393) has the molecular formula C15H22ClFN2O and a molecular weight of 300.81 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride
PubChem CID119275393
Molecular FormulaC15H22ClFN2O
Molecular Weight300.81 g/mol
Exact Mass300.14
IUPAC NameN-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride
SMILESCC(c1ccc(F)cc1)N(C)C(=O)C1CCNCC1.Cl
InChIInChI=1S/C15H21FN2O.ClH/c1-11(12-3-5-14(16)6-4-12)18(2)15(19)13-7-9-17-10-8-13;/h3-6,11,13,17H,7-10H2,1-2H3;1H
InChIKeyZIEDHFYYLZMWQU-UHFFFAOYSA-N
XLogP2.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.81
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-N-methylpiperidine-4-carboxamide
CID 145326526
N-methyl-N-(1-phenylethyl)pyrrolidine-3-carboxamide
CID 63005298
N-[1-(4-fluorophenyl)ethyl]-N-methylpyrrolidine-2-carboxamide
CID 54869659
N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-4-yloxyacetamide
CID 63877072
N-[1-(4-bromophenyl)ethyl]-N-methylcyclopropanecarboxamide
CID 163259808
N-methyl-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide
CID 54873202
N-methyl-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119337319
N-[(1S)-1-(4-fluorophenyl)ethyl]-N-methyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 34152158
(3S)-N-methyl-N-[1-(4-methylphenyl)ethyl]piperidine-3-carboxamide
CID 81129873
1-(5-chloro-2-methoxybenzoyl)-N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide
CID 55623180
2-(azetidin-3-yl)-N-[1-(4-fluorophenyl)ethyl]-N-methylpropanamide
CID 116676248
N-[1-(4-fluorophenyl)ethyl]-N-methyl-5-oxo-1-pentan-3-ylpyrrolidine-3-carboxamide
CID 112826714

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride (CID 119275393) is N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride is CC(c1ccc(F)cc1)N(C)C(=O)C1CCNCC1.Cl.
What is the InChIKey of N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride?
The InChIKey is ZIEDHFYYLZMWQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O.ClH/c1-11(12-3-5-14(16)6-4-12)18(2)15(19)13-7-9-17-10-8-13;/h3-6,11,13,17H,7-10H2,1-2H3;1H.
What are the key properties of N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride?
N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride has a molecular weight of 300.81 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119275393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).