N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine

C15H16Cl2N2O — CID 43706442

IUPACN-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine
SMILESCCOc1ncccc1NC(C)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H16Cl2N2O/c1-3-20-15-14(5-4-8-18-15)19-10(2)12-7-6-11(16)9-13(12)17/h4-10,19H,3H2,1-2H3
InChIKeyULIYDJZSOQWSEW-UHFFFAOYSA-N
MW311.21 g/mol
LogP4.96
Rot. Bonds5

About N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine

N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine (PubChem CID 43706442) has the molecular formula C15H16Cl2N2O and a molecular weight of 311.21 g/mol. Its IUPAC name is N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine.

Molecular Properties

Compound NameN-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine
PubChem CID43706442
Molecular FormulaC15H16Cl2N2O
Molecular Weight311.21 g/mol
Exact Mass310.06
IUPAC NameN-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine
SMILESCCOc1ncccc1NC(C)c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H16Cl2N2O/c1-3-20-15-14(5-4-8-18-15)19-10(2)12-7-6-11(16)9-13(12)17/h4-10,19H,3H2,1-2H3
InChIKeyULIYDJZSOQWSEW-UHFFFAOYSA-N
XLogP4.96
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.21
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine
CID 43706283
N-[1-(4-chloro-3-fluorophenyl)ethyl]-2-ethoxypyridin-3-amine
CID 83069768
N-[1-(2,5-dichlorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721804
N-[1-(2,4-dichlorophenyl)ethyl]pyrimidin-2-amine
CID 43080819
N-[(2,4-dichlorophenyl)methyl]-2-ethoxypyridin-3-amine
CID 43706260
2-ethoxy-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 43706285
N-[1-(2-chlorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721825
N-[1-(2,4-dichlorophenyl)ethyl]-4-ethoxy-2-methylaniline
CID 63451092
2-N-(2-ethoxy-3-pyridinyl)propane-1,2-diamine
CID 103388376
2-ethoxy-N-[1-(2-nitrophenyl)ethyl]pyridin-3-amine
CID 43706375
3-chloro-N-[1-(2,4-dichlorophenyl)ethyl]pyridin-4-amine
CID 79840895
2-ethoxy-N-(3-methoxybutan-2-yl)pyridin-3-amine
CID 115922159

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine?
The IUPAC name of N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine (CID 43706442) is N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine.
What is the SMILES notation for N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine?
The canonical SMILES for N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine is CCOc1ncccc1NC(C)c1ccc(Cl)cc1Cl.
What is the InChIKey of N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine?
The InChIKey is ULIYDJZSOQWSEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2O/c1-3-20-15-14(5-4-8-18-15)19-10(2)12-7-6-11(16)9-13(12)17/h4-10,19H,3H2,1-2H3.
What are the key properties of N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine?
N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine has a molecular weight of 311.21 g/mol, XLogP of 4.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine is sourced from PubChem (CID 43706442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).