4-(furan-2-ylmethylamino)pyridine-2-carbonitrile

C11H9N3O — CID 62924814

IUPAC4-(furan-2-ylmethylamino)pyridine-2-carbonitrile
SMILESN#Cc1cc(NCc2ccco2)ccn1
InChIInChI=1S/C11H9N3O/c12-7-10-6-9(3-4-13-10)14-8-11-2-1-5-15-11/h1-6H,8H2,(H,13,14)
InChIKeyHFUNECCGTOAXDU-UHFFFAOYSA-N
MW199.21 g/mol
LogP2.16
Rot. Bonds3

About 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile

4-(furan-2-ylmethylamino)pyridine-2-carbonitrile (PubChem CID 62924814) has the molecular formula C11H9N3O and a molecular weight of 199.21 g/mol. Its IUPAC name is 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-(furan-2-ylmethylamino)pyridine-2-carbonitrile
PubChem CID62924814
Molecular FormulaC11H9N3O
Molecular Weight199.21 g/mol
Exact Mass199.07
IUPAC Name4-(furan-2-ylmethylamino)pyridine-2-carbonitrile
SMILESN#Cc1cc(NCc2ccco2)ccn1
InChIInChI=1S/C11H9N3O/c12-7-10-6-9(3-4-13-10)14-8-11-2-1-5-15-11/h1-6H,8H2,(H,13,14)
InChIKeyHFUNECCGTOAXDU-UHFFFAOYSA-N
XLogP2.16
TPSA61.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.21
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(furan-2-ylmethylamino)methyl]pyridine-2-carbonitrile
CID 63881885
4-[(4-cyanophenyl)methylamino]pyridine-2-carbonitrile
CID 62925693
3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile
CID 62671433
N-(furan-2-ylmethyl)pyrimidin-2-amine
CID 28514232
3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile
CID 80508635
4-(methylamino)pyridine-2-carbonitrile
CID 45079907
4-(3,3,3-trifluoropropylamino)pyridine-2-carbonitrile
CID 63226781
4-(3-aminopropylamino)pyridine-2-carbonitrile
CID 62926383
4-(2-methoxyethylamino)pyridine-2-carbonitrile
CID 62924815
2-[(2-cyano-4-pyridinyl)amino]acetamide
CID 62924991
4-(2,3-dimethylbutylamino)pyridine-2-carbonitrile
CID 64596884
4-[(4-methyl-1,2,4-triazol-3-yl)methylamino]pyridine-2-carbonitrile
CID 62924484

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile?
The IUPAC name of 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile (CID 62924814) is 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile.
What is the SMILES notation for 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile?
The canonical SMILES for 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile is N#Cc1cc(NCc2ccco2)ccn1.
What is the InChIKey of 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile?
The InChIKey is HFUNECCGTOAXDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O/c12-7-10-6-9(3-4-13-10)14-8-11-2-1-5-15-11/h1-6H,8H2,(H,13,14).
What are the key properties of 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile?
4-(furan-2-ylmethylamino)pyridine-2-carbonitrile has a molecular weight of 199.21 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-ylmethylamino)pyridine-2-carbonitrile is sourced from PubChem (CID 62924814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).