6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine

C15H17ClN2O2 — CID 43262611

IUPAC6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine
SMILESCc1ccc(Cl)c(Oc2ccc(N)c(OC(C)C)n2)c1
InChIInChI=1S/C15H17ClN2O2/c1-9(2)19-15-12(17)6-7-14(18-15)20-13-8-10(3)4-5-11(13)16/h4-9H,17H2,1-3H3
InChIKeyONFMJLJTYKDYGI-UHFFFAOYSA-N
MW292.77 g/mol
LogP4.21
Rot. Bonds4

About 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine

6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine (PubChem CID 43262611) has the molecular formula C15H17ClN2O2 and a molecular weight of 292.77 g/mol. Its IUPAC name is 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound Name6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine
PubChem CID43262611
Molecular FormulaC15H17ClN2O2
Molecular Weight292.77 g/mol
Exact Mass292.10
IUPAC Name6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine
SMILESCc1ccc(Cl)c(Oc2ccc(N)c(OC(C)C)n2)c1
InChIInChI=1S/C15H17ClN2O2/c1-9(2)19-15-12(17)6-7-14(18-15)20-13-8-10(3)4-5-11(13)16/h4-9H,17H2,1-3H3
InChIKeyONFMJLJTYKDYGI-UHFFFAOYSA-N
XLogP4.21
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine (CID 43262611) is 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine is Cc1ccc(Cl)c(Oc2ccc(N)c(OC(C)C)n2)c1.
What is the InChIKey of 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine?
The InChIKey is ONFMJLJTYKDYGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O2/c1-9(2)19-15-12(17)6-7-14(18-15)20-13-8-10(3)4-5-11(13)16/h4-9H,17H2,1-3H3.
What are the key properties of 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine?
6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine has a molecular weight of 292.77 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chloro-5-methylphenoxy)-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 43262611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).