5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine

C11H15N3O — CID 145146754

IUPAC5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine
SMILESNc1ccc(N2CC3COCC3C2)cn1
InChIInChI=1S/C11H15N3O/c12-11-2-1-10(3-13-11)14-4-8-6-15-7-9(8)5-14/h1-3,8-9H,4-7H2,(H2,12,13)
InChIKeyHPFJQQATQAUPNJ-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.75
Rot. Bonds1

About 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine

5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine (PubChem CID 145146754) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine
PubChem CID145146754
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine
SMILESNc1ccc(N2CC3COCC3C2)cn1
InChIInChI=1S/C11H15N3O/c12-11-2-1-10(3-13-11)14-4-8-6-15-7-9(8)5-14/h1-3,8-9H,4-7H2,(H2,12,13)
InChIKeyHPFJQQATQAUPNJ-UHFFFAOYSA-N
XLogP0.75
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine?
The IUPAC name of 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine (CID 145146754) is 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine.
What is the SMILES notation for 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine?
The canonical SMILES for 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine is Nc1ccc(N2CC3COCC3C2)cn1.
What is the InChIKey of 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine?
The InChIKey is HPFJQQATQAUPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c12-11-2-1-10(3-13-11)14-4-8-6-15-7-9(8)5-14/h1-3,8-9H,4-7H2,(H2,12,13).
What are the key properties of 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine?
5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine has a molecular weight of 205.26 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrol-5-yl)pyridin-2-amine is sourced from PubChem (CID 145146754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).