3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile

C19H12F2N6 — CID 123416065

IUPAC3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile
SMILESN#Cc1ccncc1Nc1cc2c(cn1)cnn2Cc1cc(F)ccc1F
InChIInChI=1S/C19H12F2N6/c20-15-1-2-16(21)13(5-15)11-27-18-6-19(24-8-14(18)9-25-27)26-17-10-23-4-3-12(17)7-22/h1-6,8-10H,11H2,(H,24,26)
InChIKeyLOVFNCKLQNCSIP-UHFFFAOYSA-N
MW362.34 g/mol
LogP3.77
Rot. Bonds4

About 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile

3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile (PubChem CID 123416065) has the molecular formula C19H12F2N6 and a molecular weight of 362.34 g/mol. Its IUPAC name is 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile.

Molecular Properties

Compound Name3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile
PubChem CID123416065
Molecular FormulaC19H12F2N6
Molecular Weight362.34 g/mol
Exact Mass362.11
IUPAC Name3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile
SMILESN#Cc1ccncc1Nc1cc2c(cn1)cnn2Cc1cc(F)ccc1F
InChIInChI=1S/C19H12F2N6/c20-15-1-2-16(21)13(5-15)11-27-18-6-19(24-8-14(18)9-25-27)26-17-10-23-4-3-12(17)7-22/h1-6,8-10H,11H2,(H,24,26)
InChIKeyLOVFNCKLQNCSIP-UHFFFAOYSA-N
XLogP3.77
TPSA79.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.34
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile?
The IUPAC name of 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile (CID 123416065) is 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile.
What is the SMILES notation for 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile?
The canonical SMILES for 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile is N#Cc1ccncc1Nc1cc2c(cn1)cnn2Cc1cc(F)ccc1F.
What is the InChIKey of 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile?
The InChIKey is LOVFNCKLQNCSIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F2N6/c20-15-1-2-16(21)13(5-15)11-27-18-6-19(24-8-14(18)9-25-27)26-17-10-23-4-3-12(17)7-22/h1-6,8-10H,11H2,(H,24,26).
What are the key properties of 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile?
3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile has a molecular weight of 362.34 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[1-[(2,5-difluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]amino]pyridine-4-carbonitrile is sourced from PubChem (CID 123416065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).