6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine

C14H15N3 — CID 80646724

IUPAC6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine
SMILESNc1cccc(Nc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C14H15N3/c15-13-5-2-6-14(17-13)16-12-8-7-10-3-1-4-11(10)9-12/h2,5-9H,1,3-4H2,(H3,15,16,17)
InChIKeyDSSABLRWBJGHLG-UHFFFAOYSA-N
MW225.30 g/mol
LogP2.90
Rot. Bonds2

About 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine

6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine (PubChem CID 80646724) has the molecular formula C14H15N3 and a molecular weight of 225.30 g/mol. Its IUPAC name is 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine
PubChem CID80646724
Molecular FormulaC14H15N3
Molecular Weight225.30 g/mol
Exact Mass225.13
IUPAC Name6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine
SMILESNc1cccc(Nc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C14H15N3/c15-13-5-2-6-14(17-13)16-12-8-7-10-3-1-4-11(10)9-12/h2,5-9H,1,3-4H2,(H3,15,16,17)
InChIKeyDSSABLRWBJGHLG-UHFFFAOYSA-N
XLogP2.90
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine?
The IUPAC name of 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine (CID 80646724) is 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine.
What is the SMILES notation for 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine?
The canonical SMILES for 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine is Nc1cccc(Nc2ccc3c(c2)CCC3)n1.
What is the InChIKey of 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine?
The InChIKey is DSSABLRWBJGHLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3/c15-13-5-2-6-14(17-13)16-12-8-7-10-3-1-4-11(10)9-12/h2,5-9H,1,3-4H2,(H3,15,16,17).
What are the key properties of 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine?
6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine has a molecular weight of 225.30 g/mol, XLogP of 2.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2,3-dihydro-1H-inden-5-yl)pyridine-2,6-diamine is sourced from PubChem (CID 80646724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).