6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile

C13H13N5 — CID 133312990

IUPAC6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile
SMILESN#Cc1ccc(NC2CCc3[nH]ncc3C2)nc1
InChIInChI=1S/C13H13N5/c14-6-9-1-4-13(15-7-9)17-11-2-3-12-10(5-11)8-16-18-12/h1,4,7-8,11H,2-3,5H2,(H,15,17)(H,16,18)
InChIKeyVOEIGLBUEIKIMD-UHFFFAOYSA-N
MW239.28 g/mol
LogP1.65
Rot. Bonds2

About 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile

6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile (PubChem CID 133312990) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile
PubChem CID133312990
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC Name6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile
SMILESN#Cc1ccc(NC2CCc3[nH]ncc3C2)nc1
InChIInChI=1S/C13H13N5/c14-6-9-1-4-13(15-7-9)17-11-2-3-12-10(5-11)8-16-18-12/h1,4,7-8,11H,2-3,5H2,(H,15,17)(H,16,18)
InChIKeyVOEIGLBUEIKIMD-UHFFFAOYSA-N
XLogP1.65
TPSA77.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-methylpyrimidin-4-yl)-4,5,6,7-tetrahydro-1H-indazol-5-amine
CID 133314472
6-[(4-hydroxycyclohexyl)amino]pyridine-3-carbonitrile
CID 24704980
N-(6-ethyl-2-methylpyrimidin-4-yl)-4,5,6,7-tetrahydro-1H-indazol-5-amine
CID 133460777
6-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)amino]pyridine-3-carbonitrile
CID 170765192
6-[[(1S,3R)-3-methylcyclohexyl]amino]pyridine-3-carbonitrile
CID 93287060
N-(5-methyl-2-pyridinyl)-3-[[(5S)-4,5,6,7-tetrahydro-1H-indazol-5-yl]carbamoylamino]propanamide
CID 124578647
6-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)pyrido[3,2-d]pyrimidin-4-amine
CID 146043940
6-[(4-propylcyclohexyl)amino]pyridine-3-carbonitrile
CID 61371820
6-[(3-methylsulfanylcyclopentyl)amino]pyridine-3-carbonitrile
CID 103704177
6-[(2-aminocyclopropyl)amino]pyridine-3-carbonitrile
CID 43598833
4-(2,4-dioxoimidazolidin-1-yl)-N-[(5R)-4,5,6,7-tetrahydro-1H-indazol-5-yl]benzamide
CID 97137408
5-benzyl-1-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)pyrazole-4-carboxamide
CID 166218790

Frequently Asked Questions

What is the IUPAC name of 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile?
The IUPAC name of 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile (CID 133312990) is 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile?
The canonical SMILES for 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile is N#Cc1ccc(NC2CCc3[nH]ncc3C2)nc1.
What is the InChIKey of 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile?
The InChIKey is VOEIGLBUEIKIMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c14-6-9-1-4-13(15-7-9)17-11-2-3-12-10(5-11)8-16-18-12/h1,4,7-8,11H,2-3,5H2,(H,15,17)(H,16,18).
What are the key properties of 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile?
6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile has a molecular weight of 239.28 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,5,6,7-tetrahydro-1H-indazol-5-ylamino)pyridine-3-carbonitrile is sourced from PubChem (CID 133312990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).