2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile

C14H12N4 — CID 129021795

IUPAC2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile
SMILESN#Cc1ccnc(Nc2cc(C3CC3)ccn2)c1
InChIInChI=1S/C14H12N4/c15-9-10-3-5-16-13(7-10)18-14-8-12(4-6-17-14)11-1-2-11/h3-8,11H,1-2H2,(H,16,17,18)
InChIKeyWGRQJLYBTVKHTI-UHFFFAOYSA-N
MW236.28 g/mol
LogP2.97
Rot. Bonds3

About 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile

2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile (PubChem CID 129021795) has the molecular formula C14H12N4 and a molecular weight of 236.28 g/mol. Its IUPAC name is 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile
PubChem CID129021795
Molecular FormulaC14H12N4
Molecular Weight236.28 g/mol
Exact Mass236.11
IUPAC Name2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile
SMILESN#Cc1ccnc(Nc2cc(C3CC3)ccn2)c1
InChIInChI=1S/C14H12N4/c15-9-10-3-5-16-13(7-10)18-14-8-12(4-6-17-14)11-1-2-11/h3-8,11H,1-2H2,(H,16,17,18)
InChIKeyWGRQJLYBTVKHTI-UHFFFAOYSA-N
XLogP2.97
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[(4-cyclopropyl-2-pyridinyl)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

Related Compounds

2-[[4-(1-methylsulfanylpiperidin-4-yl)-2-pyridinyl]amino]pyridine-4-carbonitrile
CID 134293686
2-[[4-cyclopropyl-6-(6-piperazin-1-yl-3-pyridinyl)-2-pyridinyl]amino]pyridine-4-carbonitrile;hydrochloride
CID 86694846
2-anilinopyridine-4-carbonitrile
CID 24696970
2-[[4-cyclopropyl-6-[6-[(3-hydroxy-2,2-dimethylpropyl)amino]-3-pyridinyl]-2-pyridinyl]amino]pyridine-4-carbonitrile
CID 56970057
2-[[4-cyclopropyl-6-[5-(3-hydroxypyrrolidin-1-yl)-3-pyridinyl]-2-pyridinyl]amino]pyridine-4-carbonitrile
CID 56968316
2-[[6-(3,3-difluoropyrrolidin-1-yl)-4-piperidin-4-yl-2-pyridinyl]amino]pyridine-4-carbonitrile
CID 162747716
2-[[4-cyclopropyl-6-[6-(2-oxopiperazin-1-yl)-3-pyridinyl]-2-pyridinyl]amino]pyridine-4-carbonitrile
CID 56970945
2-[[6-cyclobutyloxy-4-[1-(oxetan-3-yl)piperidin-4-yl]-2-pyridinyl]amino]pyridine-4-carbonitrile
CID 118725473
2-[(5-piperidin-4-yl-1-propan-2-ylpyrazol-3-yl)amino]pyridine-4-carbonitrile
CID 122193943
2-[(2-aminocyclopropyl)amino]pyridine-4-carbonitrile
CID 43598882
2-[3,5-bis(4-cyano-2-pyridinyl)cyclohexyl]pyridine-4-carbonitrile
CID 25124014
2-(pyrrolidin-3-ylamino)pyridine-4-carbonitrile;hydrochloride
CID 71643662

Frequently Asked Questions

What is the IUPAC name of 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile?
The IUPAC name of 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile (CID 129021795) is 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile.
What is the SMILES notation for 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile?
The canonical SMILES for 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile is N#Cc1ccnc(Nc2cc(C3CC3)ccn2)c1.
What is the InChIKey of 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile?
The InChIKey is WGRQJLYBTVKHTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4/c15-9-10-3-5-16-13(7-10)18-14-8-12(4-6-17-14)11-1-2-11/h3-8,11H,1-2H2,(H,16,17,18).
What are the key properties of 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile?
2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile has a molecular weight of 236.28 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile is sourced from PubChem (CID 129021795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).