1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine

C12H14N2O — CID 66448619

IUPAC1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine
SMILESCc1cccnc1CC(N)c1ccoc1
InChIInChI=1S/C12H14N2O/c1-9-3-2-5-14-12(9)7-11(13)10-4-6-15-8-10/h2-6,8,11H,7,13H2,1H3
InChIKeyLHLAGWYNIXRUDX-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.23
Rot. Bonds3

About 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine

1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine (PubChem CID 66448619) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine
PubChem CID66448619
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine
SMILESCc1cccnc1CC(N)c1ccoc1
InChIInChI=1S/C12H14N2O/c1-9-3-2-5-14-12(9)7-11(13)10-4-6-15-8-10/h2-6,8,11H,7,13H2,1H3
InChIKeyLHLAGWYNIXRUDX-UHFFFAOYSA-N
XLogP2.23
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine?
The IUPAC name of 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine (CID 66448619) is 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine is Cc1cccnc1CC(N)c1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine?
The InChIKey is LHLAGWYNIXRUDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-9-3-2-5-14-12(9)7-11(13)10-4-6-15-8-10/h2-6,8,11H,7,13H2,1H3.
What are the key properties of 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine?
1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine has a molecular weight of 202.26 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-2-(3-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 66448619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).