(1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine

C13H16N2O2 — CID 81399782

IUPAC(1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine
SMILESCOc1cccc(CN[C@H](C)c2ccco2)n1
InChIInChI=1S/C13H16N2O2/c1-10(12-6-4-8-17-12)14-9-11-5-3-7-13(15-11)16-2/h3-8,10,14H,9H2,1-2H3/t10-/m1/s1
InChIKeyZRCKNWWPNYMNKT-SNVBAGLBSA-N
MW232.28 g/mol
LogP2.53
Rot. Bonds5

About (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine

(1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine (PubChem CID 81399782) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine
PubChem CID81399782
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name(1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine
SMILESCOc1cccc(CN[C@H](C)c2ccco2)n1
InChIInChI=1S/C13H16N2O2/c1-10(12-6-4-8-17-12)14-9-11-5-3-7-13(15-11)16-2/h3-8,10,14H,9H2,1-2H3/t10-/m1/s1
InChIKeyZRCKNWWPNYMNKT-SNVBAGLBSA-N
XLogP2.53
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine?
The IUPAC name of (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine (CID 81399782) is (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine.
What is the SMILES notation for (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine?
The canonical SMILES for (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine is COc1cccc(CN[C@H](C)c2ccco2)n1.
What is the InChIKey of (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine?
The InChIKey is ZRCKNWWPNYMNKT-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-10(12-6-4-8-17-12)14-9-11-5-3-7-13(15-11)16-2/h3-8,10,14H,9H2,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine?
(1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine has a molecular weight of 232.28 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 81399782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).