N-(5-bromo-2-chlorophenyl)piperidin-3-amine

C11H14BrClN2 — CID 62913938

IUPACN-(5-bromo-2-chlorophenyl)piperidin-3-amine
SMILESClc1ccc(Br)cc1NC1CCCNC1
InChIInChI=1S/C11H14BrClN2/c12-8-3-4-10(13)11(6-8)15-9-2-1-5-14-7-9/h3-4,6,9,14-15H,1-2,5,7H2
InChIKeyITHDCZITQSGTDJ-UHFFFAOYSA-N
MW289.60 g/mol
LogP3.27
Rot. Bonds2

About N-(5-bromo-2-chlorophenyl)piperidin-3-amine

N-(5-bromo-2-chlorophenyl)piperidin-3-amine (PubChem CID 62913938) has the molecular formula C11H14BrClN2 and a molecular weight of 289.60 g/mol. Its IUPAC name is N-(5-bromo-2-chlorophenyl)piperidin-3-amine.

Molecular Properties

Compound NameN-(5-bromo-2-chlorophenyl)piperidin-3-amine
PubChem CID62913938
Molecular FormulaC11H14BrClN2
Molecular Weight289.60 g/mol
Exact Mass288.00
IUPAC NameN-(5-bromo-2-chlorophenyl)piperidin-3-amine
SMILESClc1ccc(Br)cc1NC1CCCNC1
InChIInChI=1S/C11H14BrClN2/c12-8-3-4-10(13)11(6-8)15-9-2-1-5-14-7-9/h3-4,6,9,14-15H,1-2,5,7H2
InChIKeyITHDCZITQSGTDJ-UHFFFAOYSA-N
XLogP3.27
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.60
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-2-chlorophenyl)cycloheptanamine
CID 63477399
(3R)-N-(4-bromophenyl)piperidin-3-amine
CID 167150993
N-(5-bromo-2-chlorophenyl)oxepan-4-amine
CID 65079704
N-(5-bromo-2-chlorophenyl)thian-3-amine
CID 62913384
4-N-(5-bromo-2-chlorophenyl)cyclohexane-1,4-diamine
CID 79741139
N-(2,4-dibromophenyl)pyrrolidin-3-amine
CID 79725192
N-(5-bromo-2-chlorophenyl)thietan-3-amine
CID 130870688
4-bromo-2-chloro-N-piperidin-3-ylbenzamide
CID 63321001
(3S)-3-(5-bromo-2-chlorophenyl)piperidine
CID 130619016
N-(5-bromo-2-chlorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83200174
3-N-(5-bromo-2-chlorophenyl)cyclopentane-1,3-diamine
CID 79461483
5-bromo-2-chloro-N-(3,4-dimethylcyclohexyl)aniline
CID 64744650

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-chlorophenyl)piperidin-3-amine?
The IUPAC name of N-(5-bromo-2-chlorophenyl)piperidin-3-amine (CID 62913938) is N-(5-bromo-2-chlorophenyl)piperidin-3-amine.
What is the SMILES notation for N-(5-bromo-2-chlorophenyl)piperidin-3-amine?
The canonical SMILES for N-(5-bromo-2-chlorophenyl)piperidin-3-amine is Clc1ccc(Br)cc1NC1CCCNC1.
What is the InChIKey of N-(5-bromo-2-chlorophenyl)piperidin-3-amine?
The InChIKey is ITHDCZITQSGTDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrClN2/c12-8-3-4-10(13)11(6-8)15-9-2-1-5-14-7-9/h3-4,6,9,14-15H,1-2,5,7H2.
What are the key properties of N-(5-bromo-2-chlorophenyl)piperidin-3-amine?
N-(5-bromo-2-chlorophenyl)piperidin-3-amine has a molecular weight of 289.60 g/mol, XLogP of 3.27, 2 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)piperidin-3-amine is sourced from PubChem (CID 62913938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).