2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile

C20H13N3O — CID 166594868

IUPAC2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc3ccccc3c2)cc(-c2ccco2)nc1N
InChIInChI=1S/C20H13N3O/c21-12-17-16(11-18(23-20(17)22)19-6-3-9-24-19)15-8-7-13-4-1-2-5-14(13)10-15/h1-11H,(H2,22,23)
InChIKeyLWAUPWLUZQTROY-UHFFFAOYSA-N
MW311.34 g/mol
LogP4.62
Rot. Bonds2

About 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile

2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile (PubChem CID 166594868) has the molecular formula C20H13N3O and a molecular weight of 311.34 g/mol. Its IUPAC name is 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile
PubChem CID166594868
Molecular FormulaC20H13N3O
Molecular Weight311.34 g/mol
Exact Mass311.11
IUPAC Name2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccc3ccccc3c2)cc(-c2ccco2)nc1N
InChIInChI=1S/C20H13N3O/c21-12-17-16(11-18(23-20(17)22)19-6-3-9-24-19)15-8-7-13-4-1-2-5-14(13)10-15/h1-11H,(H2,22,23)
InChIKeyLWAUPWLUZQTROY-UHFFFAOYSA-N
XLogP4.62
TPSA75.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile (CID 166594868) is 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile is N#Cc1c(-c2ccc3ccccc3c2)cc(-c2ccco2)nc1N.
What is the InChIKey of 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile?
The InChIKey is LWAUPWLUZQTROY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N3O/c21-12-17-16(11-18(23-20(17)22)19-6-3-9-24-19)15-8-7-13-4-1-2-5-14(13)10-15/h1-11H,(H2,22,23).
What are the key properties of 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile?
2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile has a molecular weight of 311.34 g/mol, XLogP of 4.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(furan-2-yl)-4-naphthalen-2-ylpyridine-3-carbonitrile is sourced from PubChem (CID 166594868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).