4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine

C12H14N4 — CID 135228206

IUPAC4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine
SMILESNc1cc(-n2cc3c(n2)CCCC3)ccn1
InChIInChI=1S/C12H14N4/c13-12-7-10(5-6-14-12)16-8-9-3-1-2-4-11(9)15-16/h5-8H,1-4H2,(H2,13,14)
InChIKeyHHAUXUHINHRELZ-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.73
Rot. Bonds1

About 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine

4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine (PubChem CID 135228206) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine
PubChem CID135228206
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine
SMILESNc1cc(-n2cc3c(n2)CCCC3)ccn1
InChIInChI=1S/C12H14N4/c13-12-7-10(5-6-14-12)16-8-9-3-1-2-4-11(9)15-16/h5-8H,1-4H2,(H2,13,14)
InChIKeyHHAUXUHINHRELZ-UHFFFAOYSA-N
XLogP1.73
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine?
The IUPAC name of 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine (CID 135228206) is 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine.
What is the SMILES notation for 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine?
The canonical SMILES for 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine is Nc1cc(-n2cc3c(n2)CCCC3)ccn1.
What is the InChIKey of 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine?
The InChIKey is HHAUXUHINHRELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c13-12-7-10(5-6-14-12)16-8-9-3-1-2-4-11(9)15-16/h5-8H,1-4H2,(H2,13,14).
What are the key properties of 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine?
4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine has a molecular weight of 214.27 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5,6,7-tetrahydroindazol-2-yl)pyridin-2-amine is sourced from PubChem (CID 135228206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).