5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine

C14H14BrClN2 — CID 115146882

IUPAC5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine
SMILESCN(CCc1ccc(Cl)cc1)c1ccc(Br)cn1
InChIInChI=1S/C14H14BrClN2/c1-18(14-7-4-12(15)10-17-14)9-8-11-2-5-13(16)6-3-11/h2-7,10H,8-9H2,1H3
InChIKeyDZYMGPRDOWWIJV-UHFFFAOYSA-N
MW325.64 g/mol
LogP4.18
Rot. Bonds4

About 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine

5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine (PubChem CID 115146882) has the molecular formula C14H14BrClN2 and a molecular weight of 325.64 g/mol. Its IUPAC name is 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine
PubChem CID115146882
Molecular FormulaC14H14BrClN2
Molecular Weight325.64 g/mol
Exact Mass324.00
IUPAC Name5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine
SMILESCN(CCc1ccc(Cl)cc1)c1ccc(Br)cn1
InChIInChI=1S/C14H14BrClN2/c1-18(14-7-4-12(15)10-17-14)9-8-11-2-5-13(16)6-3-11/h2-7,10H,8-9H2,1H3
InChIKeyDZYMGPRDOWWIJV-UHFFFAOYSA-N
XLogP4.18
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.64
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]pyridin-2-amine
CID 115146878
N-[(4-bromophenyl)methyl]-5-chloro-N-methylpyridin-2-amine
CID 66231617
N-[2-(4-bromophenyl)ethyl]-N-methylpyridin-2-amine
CID 133292178
5-bromo-N-methyl-N-(2-methylpropyl)pyridin-2-amine
CID 61373959
5-bromo-N-methyl-N-[2-(3-methylthiophen-2-yl)ethyl]pyridin-2-amine
CID 115146924
1-[(5-bromo-2-pyridinyl)-methylamino]propan-2-ol
CID 62333552
N-(5-bromo-2-pyridinyl)-4-chloro-N-methylbenzamide
CID 115268312
5-bromo-N-[(3,4-dimethylphenyl)methyl]-N-methylpyridin-2-amine
CID 115146736
N-methyl-5-(methylaminomethyl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine
CID 62284014
6-[2-(4-bromophenyl)ethyl-methylamino]pyridazine-3-carboxamide
CID 122143450
5-bromo-N-methyl-N-pentan-3-ylpyridin-2-amine
CID 61373581
5-bromo-N-(2-bromo-3-methoxypropyl)-N-methylpyridin-2-amine
CID 80674574

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine?
The IUPAC name of 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine (CID 115146882) is 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine?
The canonical SMILES for 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine is CN(CCc1ccc(Cl)cc1)c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine?
The InChIKey is DZYMGPRDOWWIJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrClN2/c1-18(14-7-4-12(15)10-17-14)9-8-11-2-5-13(16)6-3-11/h2-7,10H,8-9H2,1H3.
What are the key properties of 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine?
5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine has a molecular weight of 325.64 g/mol, XLogP of 4.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[2-(4-chlorophenyl)ethyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 115146882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).