2-(quinolin-3-ylamino)pyridine-4-carbonitrile

C15H10N4 — CID 62783439

IUPAC2-(quinolin-3-ylamino)pyridine-4-carbonitrile
SMILESN#Cc1ccnc(Nc2cnc3ccccc3c2)c1
InChIInChI=1S/C15H10N4/c16-9-11-5-6-17-15(7-11)19-13-8-12-3-1-2-4-14(12)18-10-13/h1-8,10H,(H,17,19)
InChIKeyWDWLFSOKGCVBRN-UHFFFAOYSA-N
MW246.27 g/mol
LogP3.25
Rot. Bonds2

About 2-(quinolin-3-ylamino)pyridine-4-carbonitrile

2-(quinolin-3-ylamino)pyridine-4-carbonitrile (PubChem CID 62783439) has the molecular formula C15H10N4 and a molecular weight of 246.27 g/mol. Its IUPAC name is 2-(quinolin-3-ylamino)pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-(quinolin-3-ylamino)pyridine-4-carbonitrile
PubChem CID62783439
Molecular FormulaC15H10N4
Molecular Weight246.27 g/mol
Exact Mass246.09
IUPAC Name2-(quinolin-3-ylamino)pyridine-4-carbonitrile
SMILESN#Cc1ccnc(Nc2cnc3ccccc3c2)c1
InChIInChI=1S/C15H10N4/c16-9-11-5-6-17-15(7-11)19-13-8-12-3-1-2-4-14(12)18-10-13/h1-8,10H,(H,17,19)
InChIKeyWDWLFSOKGCVBRN-UHFFFAOYSA-N
XLogP3.25
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(quinolin-3-ylamino)pyridine-4-carbonitrile?
The IUPAC name of 2-(quinolin-3-ylamino)pyridine-4-carbonitrile (CID 62783439) is 2-(quinolin-3-ylamino)pyridine-4-carbonitrile.
What is the SMILES notation for 2-(quinolin-3-ylamino)pyridine-4-carbonitrile?
The canonical SMILES for 2-(quinolin-3-ylamino)pyridine-4-carbonitrile is N#Cc1ccnc(Nc2cnc3ccccc3c2)c1.
What is the InChIKey of 2-(quinolin-3-ylamino)pyridine-4-carbonitrile?
The InChIKey is WDWLFSOKGCVBRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4/c16-9-11-5-6-17-15(7-11)19-13-8-12-3-1-2-4-14(12)18-10-13/h1-8,10H,(H,17,19).
What are the key properties of 2-(quinolin-3-ylamino)pyridine-4-carbonitrile?
2-(quinolin-3-ylamino)pyridine-4-carbonitrile has a molecular weight of 246.27 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(quinolin-3-ylamino)pyridine-4-carbonitrile is sourced from PubChem (CID 62783439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).