2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine

C16H18Cl2N2 — CID 105151514

IUPAC2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCCNC(Cc1cc(Cl)ccc1Cl)c1cncc(C)c1
InChIInChI=1S/C16H18Cl2N2/c1-3-20-16(13-6-11(2)9-19-10-13)8-12-7-14(17)4-5-15(12)18/h4-7,9-10,16,20H,3,8H2,1-2H3
InChIKeyVSCZHHQGCLCUIU-UHFFFAOYSA-N
MW309.24 g/mol
LogP4.59
Rot. Bonds5

About 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine

2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine (PubChem CID 105151514) has the molecular formula C16H18Cl2N2 and a molecular weight of 309.24 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine
PubChem CID105151514
Molecular FormulaC16H18Cl2N2
Molecular Weight309.24 g/mol
Exact Mass308.08
IUPAC Name2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCCNC(Cc1cc(Cl)ccc1Cl)c1cncc(C)c1
InChIInChI=1S/C16H18Cl2N2/c1-3-20-16(13-6-11(2)9-19-10-13)8-12-7-14(17)4-5-15(12)18/h4-7,9-10,16,20H,3,8H2,1-2H3
InChIKeyVSCZHHQGCLCUIU-UHFFFAOYSA-N
XLogP4.59
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.24
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)-N-ethylethanamine
CID 115863164
2-(5-chloro-2-fluorophenyl)-N-ethyl-1-(5-fluoro-3-pyridinyl)ethanamine
CID 103053108
2-(2,5-dichlorophenyl)-1-(3,5-dichloro-2-pyridinyl)-N-ethylethanamine
CID 79783709
[2-(2,4-dichlorophenyl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
CID 105200124
2-(3-chlorophenyl)sulfanyl-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 115374735
2-(2,5-dichlorophenyl)-N-ethyl-1-(2-methylphenyl)ethanamine
CID 65321622
2-(2,5-dichlorophenyl)-N-ethyl-1-(5-iodothiophen-3-yl)ethanamine
CID 115863174
2-(5-chloro-2-methoxyphenyl)-N-ethyl-1-pyrimidin-5-ylethanamine
CID 102923380
N-ethyl-2-ethylsulfanyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 115374602
1-(2,3-dichlorophenyl)-2-(2,5-dichlorophenyl)-N-ethylethanamine
CID 115863199
2-(4-chloro-2-fluorophenyl)-1-(3,5-dimethylphenyl)-N-ethylethanamine
CID 105055557
1-(5-chlorofuran-2-yl)-2-(2,5-dichlorophenyl)-N-ethylethanamine
CID 106692130

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine (CID 105151514) is 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine is CCNC(Cc1cc(Cl)ccc1Cl)c1cncc(C)c1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine?
The InChIKey is VSCZHHQGCLCUIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Cl2N2/c1-3-20-16(13-6-11(2)9-19-10-13)8-12-7-14(17)4-5-15(12)18/h4-7,9-10,16,20H,3,8H2,1-2H3.
What are the key properties of 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine?
2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine has a molecular weight of 309.24 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-N-ethyl-1-(5-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 105151514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).