4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine

C16H19N3 — CID 65411686

IUPAC4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine
SMILESNc1cc(CC(N)C2Cc3ccccc3C2)ccn1
InChIInChI=1S/C16H19N3/c17-15(7-11-5-6-19-16(18)8-11)14-9-12-3-1-2-4-13(12)10-14/h1-6,8,14-15H,7,9-10,17H2,(H2,18,19)
InChIKeyPIVOVVGGFUYKLM-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.95
Rot. Bonds3

About 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine

4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine (PubChem CID 65411686) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine
PubChem CID65411686
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine
SMILESNc1cc(CC(N)C2Cc3ccccc3C2)ccn1
InChIInChI=1S/C16H19N3/c17-15(7-11-5-6-19-16(18)8-11)14-9-12-3-1-2-4-13(12)10-14/h1-6,8,14-15H,7,9-10,17H2,(H2,18,19)
InChIKeyPIVOVVGGFUYKLM-UHFFFAOYSA-N
XLogP1.95
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine?
The IUPAC name of 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine (CID 65411686) is 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine is Nc1cc(CC(N)C2Cc3ccccc3C2)ccn1.
What is the InChIKey of 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine?
The InChIKey is PIVOVVGGFUYKLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c17-15(7-11-5-6-19-16(18)8-11)14-9-12-3-1-2-4-13(12)10-14/h1-6,8,14-15H,7,9-10,17H2,(H2,18,19).
What are the key properties of 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine?
4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine has a molecular weight of 253.35 g/mol, XLogP of 1.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-amino-2-(2,3-dihydro-1H-inden-2-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 65411686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).