3-furo[3,2-b]pyridin-3-ylbutan-1-amine

C11H14N2O — CID 84771544

IUPAC3-furo[3,2-b]pyridin-3-ylbutan-1-amine
SMILESCC(CCN)c1coc2cccnc12
InChIInChI=1S/C11H14N2O/c1-8(4-5-12)9-7-14-10-3-2-6-13-11(9)10/h2-3,6-8H,4-5,12H2,1H3
InChIKeyYWQBNGRYWZWVDI-UHFFFAOYSA-N
MW190.25 g/mol
LogP2.28
Rot. Bonds3

About 3-furo[3,2-b]pyridin-3-ylbutan-1-amine

3-furo[3,2-b]pyridin-3-ylbutan-1-amine (PubChem CID 84771544) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-furo[3,2-b]pyridin-3-ylbutan-1-amine.

Molecular Properties

Compound Name3-furo[3,2-b]pyridin-3-ylbutan-1-amine
PubChem CID84771544
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name3-furo[3,2-b]pyridin-3-ylbutan-1-amine
SMILESCC(CCN)c1coc2cccnc12
InChIInChI=1S/C11H14N2O/c1-8(4-5-12)9-7-14-10-3-2-6-13-11(9)10/h2-3,6-8H,4-5,12H2,1H3
InChIKeyYWQBNGRYWZWVDI-UHFFFAOYSA-N
XLogP2.28
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-furo[3,2-b]pyridin-3-ylbutan-1-amine?
The IUPAC name of 3-furo[3,2-b]pyridin-3-ylbutan-1-amine (CID 84771544) is 3-furo[3,2-b]pyridin-3-ylbutan-1-amine.
What is the SMILES notation for 3-furo[3,2-b]pyridin-3-ylbutan-1-amine?
The canonical SMILES for 3-furo[3,2-b]pyridin-3-ylbutan-1-amine is CC(CCN)c1coc2cccnc12.
What is the InChIKey of 3-furo[3,2-b]pyridin-3-ylbutan-1-amine?
The InChIKey is YWQBNGRYWZWVDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-8(4-5-12)9-7-14-10-3-2-6-13-11(9)10/h2-3,6-8H,4-5,12H2,1H3.
What are the key properties of 3-furo[3,2-b]pyridin-3-ylbutan-1-amine?
3-furo[3,2-b]pyridin-3-ylbutan-1-amine has a molecular weight of 190.25 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-furo[3,2-b]pyridin-3-ylbutan-1-amine is sourced from PubChem (CID 84771544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).