2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine

C15H16Cl2N2 — CID 62602818

IUPAC2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine
SMILESCCNC(Cc1c(Cl)cccc1Cl)c1ccccn1
InChIInChI=1S/C15H16Cl2N2/c1-2-18-15(14-8-3-4-9-19-14)10-11-12(16)6-5-7-13(11)17/h3-9,15,18H,2,10H2,1H3
InChIKeyONTLQLLNSIWYMN-UHFFFAOYSA-N
MW295.21 g/mol
LogP4.28
Rot. Bonds5

About 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine

2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine (PubChem CID 62602818) has the molecular formula C15H16Cl2N2 and a molecular weight of 295.21 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine
PubChem CID62602818
Molecular FormulaC15H16Cl2N2
Molecular Weight295.21 g/mol
Exact Mass294.07
IUPAC Name2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine
SMILESCCNC(Cc1c(Cl)cccc1Cl)c1ccccn1
InChIInChI=1S/C15H16Cl2N2/c1-2-18-15(14-8-3-4-9-19-14)10-11-12(16)6-5-7-13(11)17/h3-9,15,18H,2,10H2,1H3
InChIKeyONTLQLLNSIWYMN-UHFFFAOYSA-N
XLogP4.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine (CID 62602818) is 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine is CCNC(Cc1c(Cl)cccc1Cl)c1ccccn1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine?
The InChIKey is ONTLQLLNSIWYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2/c1-2-18-15(14-8-3-4-9-19-14)10-11-12(16)6-5-7-13(11)17/h3-9,15,18H,2,10H2,1H3.
What are the key properties of 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine?
2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine has a molecular weight of 295.21 g/mol, XLogP of 4.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-ethyl-1-pyridin-2-ylethanamine is sourced from PubChem (CID 62602818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).