5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine

C15H18N2O2 — CID 104861065

IUPAC5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
SMILESCOc1ccc(NCCc2cccc(OC)c2)nc1
InChIInChI=1S/C15H18N2O2/c1-18-13-5-3-4-12(10-13)8-9-16-15-7-6-14(19-2)11-17-15/h3-7,10-11H,8-9H2,1-2H3,(H,16,17)
InChIKeyFTYWVVSJMYPUTH-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.75
Rot. Bonds6

About 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine

5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine (PubChem CID 104861065) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
PubChem CID104861065
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
SMILESCOc1ccc(NCCc2cccc(OC)c2)nc1
InChIInChI=1S/C15H18N2O2/c1-18-13-5-3-4-12(10-13)8-9-16-15-7-6-14(19-2)11-17-15/h3-7,10-11H,8-9H2,1-2H3,(H,16,17)
InChIKeyFTYWVVSJMYPUTH-UHFFFAOYSA-N
XLogP2.75
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine?
The IUPAC name of 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine (CID 104861065) is 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine.
What is the SMILES notation for 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine?
The canonical SMILES for 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine is COc1ccc(NCCc2cccc(OC)c2)nc1.
What is the InChIKey of 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine?
The InChIKey is FTYWVVSJMYPUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-18-13-5-3-4-12(10-13)8-9-16-15-7-6-14(19-2)11-17-15/h3-7,10-11H,8-9H2,1-2H3,(H,16,17).
What are the key properties of 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine?
5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine has a molecular weight of 258.32 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine is sourced from PubChem (CID 104861065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).