2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine

C13H16N2O2 — CID 43721921

IUPAC2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine
SMILESCOc1ncccc1NC(C)c1ccc(C)o1
InChIInChI=1S/C13H16N2O2/c1-9-6-7-12(17-9)10(2)15-11-5-4-8-14-13(11)16-3/h4-8,10,15H,1-3H3
InChIKeyXXRAQHQIKOIMBU-UHFFFAOYSA-N
MW232.28 g/mol
LogP3.16
Rot. Bonds4

About 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine

2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine (PubChem CID 43721921) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine.

Molecular Properties

Compound Name2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine
PubChem CID43721921
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine
SMILESCOc1ncccc1NC(C)c1ccc(C)o1
InChIInChI=1S/C13H16N2O2/c1-9-6-7-12(17-9)10(2)15-11-5-4-8-14-13(11)16-3/h4-8,10,15H,1-3H3
InChIKeyXXRAQHQIKOIMBU-UHFFFAOYSA-N
XLogP3.16
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine?
The IUPAC name of 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine (CID 43721921) is 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine.
What is the SMILES notation for 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine?
The canonical SMILES for 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine is COc1ncccc1NC(C)c1ccc(C)o1.
What is the InChIKey of 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine?
The InChIKey is XXRAQHQIKOIMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-9-6-7-12(17-9)10(2)15-11-5-4-8-14-13(11)16-3/h4-8,10,15H,1-3H3.
What are the key properties of 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine?
2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine has a molecular weight of 232.28 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine is sourced from PubChem (CID 43721921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).