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

C15H17ClN2O — CID 43706283

IUPACN-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine
SMILESCCOc1ncccc1NC(C)c1ccc(Cl)cc1
InChIInChI=1S/C15H17ClN2O/c1-3-19-15-14(5-4-10-17-15)18-11(2)12-6-8-13(16)9-7-12/h4-11,18H,3H2,1-2H3
InChIKeyAASWQDMORNKCHA-UHFFFAOYSA-N
MW276.77 g/mol
LogP4.31
Rot. Bonds5

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

N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine (PubChem CID 43706283) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine.

Molecular Properties

Compound NameN-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine
PubChem CID43706283
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC NameN-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine
SMILESCCOc1ncccc1NC(C)c1ccc(Cl)cc1
InChIInChI=1S/C15H17ClN2O/c1-3-19-15-14(5-4-10-17-15)18-11(2)12-6-8-13(16)9-7-12/h4-11,18H,3H2,1-2H3
InChIKeyAASWQDMORNKCHA-UHFFFAOYSA-N
XLogP4.31
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-chloro-3-fluorophenyl)ethyl]-2-ethoxypyridin-3-amine
CID 83069768
N-[1-(2,4-dichlorophenyl)ethyl]-2-ethoxypyridin-3-amine
CID 43706442
2-ethoxy-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 43706285
2-N-(2-ethoxy-3-pyridinyl)propane-1,2-diamine
CID 103388376
5-chloro-N-[1-(4-chlorophenyl)ethyl]-2-ethoxyaniline
CID 63451342
2-ethoxy-N-(3-methoxybutan-2-yl)pyridin-3-amine
CID 115922159
2-[(2-ethoxy-3-pyridinyl)amino]propanoic acid
CID 66173717
N-[1-(4-chlorophenyl)ethyl]-2-propoxyaniline
CID 43682265
N-[1-(2,5-dichlorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721804
2-ethoxy-N-[1-(2-nitrophenyl)ethyl]pyridin-3-amine
CID 43706375
8-chloro-N-[1-(4-chlorophenyl)ethyl]quinolin-5-amine
CID 43731715
N-[1-(4-methoxyphenyl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 61374245

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine?
The IUPAC name of N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine (CID 43706283) is N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine.
What is the SMILES notation for N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine?
The canonical SMILES for N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine is CCOc1ncccc1NC(C)c1ccc(Cl)cc1.
What is the InChIKey of N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine?
The InChIKey is AASWQDMORNKCHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O/c1-3-19-15-14(5-4-10-17-15)18-11(2)12-6-8-13(16)9-7-12/h4-11,18H,3H2,1-2H3.
What are the key properties of N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine?
N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine has a molecular weight of 276.77 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-chlorophenyl)ethyl]-2-ethoxypyridin-3-amine is sourced from PubChem (CID 43706283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).