N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide

C15H20BrClN2O — CID 83200174

IUPACN-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
SMILESCC(C)(C(=O)Nc1cc(Br)ccc1Cl)C1CCCNC1
InChIInChI=1S/C15H20BrClN2O/c1-15(2,10-4-3-7-18-9-10)14(20)19-13-8-11(16)5-6-12(13)17/h5-6,8,10,18H,3-4,7,9H2,1-2H3,(H,19,20)
InChIKeyRFRZVYXTOONXQR-UHFFFAOYSA-N
MW359.70 g/mol
LogP4.07
Rot. Bonds3

About N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide

N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide (PubChem CID 83200174) has the molecular formula C15H20BrClN2O and a molecular weight of 359.70 g/mol. Its IUPAC name is N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide.

Molecular Properties

Compound NameN-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
PubChem CID83200174
Molecular FormulaC15H20BrClN2O
Molecular Weight359.70 g/mol
Exact Mass358.04
IUPAC NameN-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
SMILESCC(C)(C(=O)Nc1cc(Br)ccc1Cl)C1CCCNC1
InChIInChI=1S/C15H20BrClN2O/c1-15(2,10-4-3-7-18-9-10)14(20)19-13-8-11(16)5-6-12(13)17/h5-6,8,10,18H,3-4,7,9H2,1-2H3,(H,19,20)
InChIKeyRFRZVYXTOONXQR-UHFFFAOYSA-N
XLogP4.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.70
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dimethylphenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83031146
N-(2,5-difluorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83198550
2-amino-N-(5-bromo-2-chlorophenyl)-2-cyclopropylpropanamide
CID 62908062
N-(2-fluorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83031990
N-(2-methoxy-4-methylphenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83198711
N-(3-chloro-4-cyanophenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83199456
N-(4-bromo-3-fluorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83032094
N-[(1S)-1-(4-bromophenyl)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83200389
N-(5-bromo-2-chlorophenyl)piperidin-3-amine
CID 62913938
N-(6-bromo-3-pyridinyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 103885084
(3S)-N-(5-bromo-2-hydroxyphenyl)piperidine-3-carboxamide
CID 81135195
N,2-dimethyl-2-piperidin-3-ylpropanamide
CID 83031239

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide?
The IUPAC name of N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide (CID 83200174) is N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide.
What is the SMILES notation for N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide?
The canonical SMILES for N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide is CC(C)(C(=O)Nc1cc(Br)ccc1Cl)C1CCCNC1.
What is the InChIKey of N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide?
The InChIKey is RFRZVYXTOONXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrClN2O/c1-15(2,10-4-3-7-18-9-10)14(20)19-13-8-11(16)5-6-12(13)17/h5-6,8,10,18H,3-4,7,9H2,1-2H3,(H,19,20).
What are the key properties of N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide?
N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide has a molecular weight of 359.70 g/mol, XLogP of 4.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide is sourced from PubChem (CID 83200174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).