N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine

C13H18Br2N2 — CID 43683069

IUPACN-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine
SMILESCCN1CCC(Nc2ccc(Br)cc2Br)CC1
InChIInChI=1S/C13H18Br2N2/c1-2-17-7-5-11(6-8-17)16-13-4-3-10(14)9-12(13)15/h3-4,9,11,16H,2,5-8H2,1H3
InChIKeyJFCPQIIQZXFXEW-UHFFFAOYSA-N
MW362.11 g/mol
LogP4.11
Rot. Bonds3

About N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine

N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine (PubChem CID 43683069) has the molecular formula C13H18Br2N2 and a molecular weight of 362.11 g/mol. Its IUPAC name is N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine
PubChem CID43683069
Molecular FormulaC13H18Br2N2
Molecular Weight362.11 g/mol
Exact Mass359.98
IUPAC NameN-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine
SMILESCCN1CCC(Nc2ccc(Br)cc2Br)CC1
InChIInChI=1S/C13H18Br2N2/c1-2-17-7-5-11(6-8-17)16-13-4-3-10(14)9-12(13)15/h3-4,9,11,16H,2,5-8H2,1H3
InChIKeyJFCPQIIQZXFXEW-UHFFFAOYSA-N
XLogP4.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.11
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-dibromophenyl)-1-methylpiperidin-4-amine
CID 43683065
N-(5-bromo-2-fluorophenyl)-1-ethylazepan-4-amine
CID 65074592
ethyl 4-(2,4-dibromoanilino)piperidine-1-carboxylate
CID 43780824
N-(5-bromo-2-methoxyphenyl)-1-ethylazepan-4-amine
CID 65073536
N-(4-bromo-2,6-dichlorophenyl)-1-ethylpiperidin-4-amine
CID 28993181
N-(3-bromophenyl)-1-ethylazepan-4-amine
CID 65072536
3-bromo-4-[(1-propylpiperidin-4-yl)amino]benzoic acid
CID 82800456
1-ethyl-N-(2,4,5-trifluorophenyl)piperidin-4-amine
CID 62816568
N-(2,4-dibromophenyl)-4-methylcycloheptan-1-amine
CID 65080810
N-(2,4-dibromophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 43683153
2,5-dibromo-N-(1-ethylpiperidin-4-yl)benzamide
CID 114371806
N-(2,4-dibromophenyl)pyrrolidin-3-amine
CID 79725192

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine?
The IUPAC name of N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine (CID 43683069) is N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine.
What is the SMILES notation for N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine?
The canonical SMILES for N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine is CCN1CCC(Nc2ccc(Br)cc2Br)CC1.
What is the InChIKey of N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine?
The InChIKey is JFCPQIIQZXFXEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18Br2N2/c1-2-17-7-5-11(6-8-17)16-13-4-3-10(14)9-12(13)15/h3-4,9,11,16H,2,5-8H2,1H3.
What are the key properties of N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine?
N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine has a molecular weight of 362.11 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dibromophenyl)-1-ethylpiperidin-4-amine is sourced from PubChem (CID 43683069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).