N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine

C12H14N2O2 — CID 103932113

IUPACN-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine
SMILESCOc1ccc(NC(C)c2ccco2)nc1
InChIInChI=1S/C12H14N2O2/c1-9(11-4-3-7-16-11)14-12-6-5-10(15-2)8-13-12/h3-9H,1-2H3,(H,13,14)
InChIKeyZNCBUHACTSDGHE-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.86
Rot. Bonds4

About N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine

N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine (PubChem CID 103932113) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine
PubChem CID103932113
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC NameN-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine
SMILESCOc1ccc(NC(C)c2ccco2)nc1
InChIInChI=1S/C12H14N2O2/c1-9(11-4-3-7-16-11)14-12-6-5-10(15-2)8-13-12/h3-9H,1-2H3,(H,13,14)
InChIKeyZNCBUHACTSDGHE-UHFFFAOYSA-N
XLogP2.86
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine (CID 103932113) is N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine is COc1ccc(NC(C)c2ccco2)nc1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine?
The InChIKey is ZNCBUHACTSDGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-9(11-4-3-7-16-11)14-12-6-5-10(15-2)8-13-12/h3-9H,1-2H3,(H,13,14).
What are the key properties of N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine?
N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine has a molecular weight of 218.26 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine is sourced from PubChem (CID 103932113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).