3-chloro-4-ethoxypyridin-2-amine

C7H9ClN2O — CID 154642114

IUPAC3-chloro-4-ethoxypyridin-2-amine
SMILESCCOc1ccnc(N)c1Cl
InChIInChI=1S/C7H9ClN2O/c1-2-11-5-3-4-10-7(9)6(5)8/h3-4H,2H2,1H3,(H2,9,10)
InChIKeyGBWXGJXWILINJL-UHFFFAOYSA-N
MW172.62 g/mol
LogP1.72
Rot. Bonds2

About 3-chloro-4-ethoxypyridin-2-amine

3-chloro-4-ethoxypyridin-2-amine (PubChem CID 154642114) has the molecular formula C7H9ClN2O and a molecular weight of 172.62 g/mol. Its IUPAC name is 3-chloro-4-ethoxypyridin-2-amine.

Molecular Properties

Compound Name3-chloro-4-ethoxypyridin-2-amine
PubChem CID154642114
Molecular FormulaC7H9ClN2O
Molecular Weight172.62 g/mol
Exact Mass172.04
IUPAC Name3-chloro-4-ethoxypyridin-2-amine
SMILESCCOc1ccnc(N)c1Cl
InChIInChI=1S/C7H9ClN2O/c1-2-11-5-3-4-10-7(9)6(5)8/h3-4H,2H2,1H3,(H2,9,10)
InChIKeyGBWXGJXWILINJL-UHFFFAOYSA-N
XLogP1.72
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.62
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-ethoxypyridin-2-amine?
The IUPAC name of 3-chloro-4-ethoxypyridin-2-amine (CID 154642114) is 3-chloro-4-ethoxypyridin-2-amine.
What is the SMILES notation for 3-chloro-4-ethoxypyridin-2-amine?
The canonical SMILES for 3-chloro-4-ethoxypyridin-2-amine is CCOc1ccnc(N)c1Cl.
What is the InChIKey of 3-chloro-4-ethoxypyridin-2-amine?
The InChIKey is GBWXGJXWILINJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2O/c1-2-11-5-3-4-10-7(9)6(5)8/h3-4H,2H2,1H3,(H2,9,10).
What are the key properties of 3-chloro-4-ethoxypyridin-2-amine?
3-chloro-4-ethoxypyridin-2-amine has a molecular weight of 172.62 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-ethoxypyridin-2-amine is sourced from PubChem (CID 154642114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).