2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile

C13H11N3O — CID 659053

IUPAC2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccco2)cc(C2CC2)nc1N
InChIInChI=1S/C13H11N3O/c14-7-10-9(12-2-1-5-17-12)6-11(8-3-4-8)16-13(10)15/h1-2,5-6,8H,3-4H2,(H2,15,16)
InChIKeyRBOQIRGAUHNOOI-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.67
Rot. Bonds2

About 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile

2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile (PubChem CID 659053) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile
PubChem CID659053
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccco2)cc(C2CC2)nc1N
InChIInChI=1S/C13H11N3O/c14-7-10-9(12-2-1-5-17-12)6-11(8-3-4-8)16-13(10)15/h1-2,5-6,8H,3-4H2,(H2,15,16)
InChIKeyRBOQIRGAUHNOOI-UHFFFAOYSA-N
XLogP2.67
TPSA75.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile (CID 659053) is 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile is N#Cc1c(-c2ccco2)cc(C2CC2)nc1N.
What is the InChIKey of 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile?
The InChIKey is RBOQIRGAUHNOOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c14-7-10-9(12-2-1-5-17-12)6-11(8-3-4-8)16-13(10)15/h1-2,5-6,8H,3-4H2,(H2,15,16).
What are the key properties of 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile?
2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile has a molecular weight of 225.25 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 659053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).