2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride

C15H22BrClN2O — CID 119390315

IUPAC2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride
SMILESCC(C)(C(=O)NC1CCNCC1)c1ccc(Br)cc1.Cl
InChIInChI=1S/C15H21BrN2O.ClH/c1-15(2,11-3-5-12(16)6-4-11)14(19)18-13-7-9-17-10-8-13;/h3-6,13,17H,7-10H2,1-2H3,(H,18,19);1H
InChIKeyFXOARFMSKDAURK-UHFFFAOYSA-N
MW361.71 g/mol
LogP3.02
Rot. Bonds3

About 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride

2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride (PubChem CID 119390315) has the molecular formula C15H22BrClN2O and a molecular weight of 361.71 g/mol. Its IUPAC name is 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride.

Molecular Properties

Compound Name2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride
PubChem CID119390315
Molecular FormulaC15H22BrClN2O
Molecular Weight361.71 g/mol
Exact Mass360.06
IUPAC Name2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride
SMILESCC(C)(C(=O)NC1CCNCC1)c1ccc(Br)cc1.Cl
InChIInChI=1S/C15H21BrN2O.ClH/c1-15(2,11-3-5-12(16)6-4-11)14(19)18-13-7-9-17-10-8-13;/h3-6,13,17H,7-10H2,1-2H3,(H,18,19);1H
InChIKeyFXOARFMSKDAURK-UHFFFAOYSA-N
XLogP3.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.71
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenyl)-2-methyl-N-pyrrolidin-3-ylpropanamide
CID 119454206
2-(4-fluorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
CID 119387447
2-(4-bromophenyl)-N-(4-hydroxycyclohexyl)-2-methylpropanamide
CID 110893819
2-methyl-2-phenyl-N-pyrrolidin-3-ylpropanamide
CID 43603539
2-(4-bromophenyl)-2-methyl-N-(2-methylpiperidin-3-yl)propanamide;hydrochloride
CID 120575309
2-(3-chlorophenyl)-2-methyl-N-piperidin-4-ylpropanamide
CID 110464819
N-cyclopentyl-2-methyl-2-(4-methylphenyl)propanamide
CID 113198015
2-methyl-N-piperidin-4-yl-2-thiophen-2-ylpropanamide
CID 119389269
2-(4-chlorophenyl)-N-cyclopentyl-2-methylpropanamide
CID 47300023
4-bromo-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119453836
2-methyl-2-[4-(2-methylpropoxy)phenyl]-N-pyrrolidin-3-ylpropanamide
CID 119451190
N-(4-aminocyclohexyl)-2-(4-aminophenyl)-2-methylpropanamide
CID 80556915

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride?
The IUPAC name of 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride (CID 119390315) is 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride.
What is the SMILES notation for 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride?
The canonical SMILES for 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride is CC(C)(C(=O)NC1CCNCC1)c1ccc(Br)cc1.Cl.
What is the InChIKey of 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride?
The InChIKey is FXOARFMSKDAURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21BrN2O.ClH/c1-15(2,11-3-5-12(16)6-4-11)14(19)18-13-7-9-17-10-8-13;/h3-6,13,17H,7-10H2,1-2H3,(H,18,19);1H.
What are the key properties of 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride?
2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride has a molecular weight of 361.71 g/mol, XLogP of 3.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-2-methyl-N-piperidin-4-ylpropanamide;hydrochloride is sourced from PubChem (CID 119390315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).