5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine

C14H13BrN2 — CID 169260360

IUPAC5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine
SMILESBrc1ccc(N[C@@H]2CCc3ccccc32)nc1
InChIInChI=1S/C14H13BrN2/c15-11-6-8-14(16-9-11)17-13-7-5-10-3-1-2-4-12(10)13/h1-4,6,8-9,13H,5,7H2,(H,16,17)/t13-/m1/s1
InChIKeyAIPNGWWTNMRJDT-CYBMUJFWSA-N
MW289.18 g/mol
LogP3.94
Rot. Bonds2

About 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine

5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine (PubChem CID 169260360) has the molecular formula C14H13BrN2 and a molecular weight of 289.18 g/mol. Its IUPAC name is 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine
PubChem CID169260360
Molecular FormulaC14H13BrN2
Molecular Weight289.18 g/mol
Exact Mass288.03
IUPAC Name5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine
SMILESBrc1ccc(N[C@@H]2CCc3ccccc32)nc1
InChIInChI=1S/C14H13BrN2/c15-11-6-8-14(16-9-11)17-13-7-5-10-3-1-2-4-12(10)13/h1-4,6,8-9,13H,5,7H2,(H,16,17)/t13-/m1/s1
InChIKeyAIPNGWWTNMRJDT-CYBMUJFWSA-N
XLogP3.94
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.18
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine?
The IUPAC name of 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine (CID 169260360) is 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine.
What is the SMILES notation for 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine?
The canonical SMILES for 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine is Brc1ccc(N[C@@H]2CCc3ccccc32)nc1.
What is the InChIKey of 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine?
The InChIKey is AIPNGWWTNMRJDT-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H13BrN2/c15-11-6-8-14(16-9-11)17-13-7-5-10-3-1-2-4-12(10)13/h1-4,6,8-9,13H,5,7H2,(H,16,17)/t13-/m1/s1.
What are the key properties of 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine?
5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine has a molecular weight of 289.18 g/mol, XLogP of 3.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[(1R)-2,3-dihydro-1H-inden-1-yl]pyridin-2-amine is sourced from PubChem (CID 169260360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).