(7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine

C8H9BrN2 — CID 97298159

IUPAC(7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine
SMILESN[C@H]1CCc2c(Br)cncc21
InChIInChI=1S/C8H9BrN2/c9-7-4-11-3-6-5(7)1-2-8(6)10/h3-4,8H,1-2,10H2/t8-/m0/s1
InChIKeyGBMIOQZBHUJOBP-QMMMGPOBSA-N
MW213.08 g/mol
LogP1.79
Rot. Bonds

About (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine

(7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine (PubChem CID 97298159) has the molecular formula C8H9BrN2 and a molecular weight of 213.08 g/mol. Its IUPAC name is (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine.

Molecular Properties

Compound Name(7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine
PubChem CID97298159
Molecular FormulaC8H9BrN2
Molecular Weight213.08 g/mol
Exact Mass211.99
IUPAC Name(7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine
SMILESN[C@H]1CCc2c(Br)cncc21
InChIInChI=1S/C8H9BrN2/c9-7-4-11-3-6-5(7)1-2-8(6)10/h3-4,8H,1-2,10H2/t8-/m0/s1
InChIKeyGBMIOQZBHUJOBP-QMMMGPOBSA-N
XLogP1.79
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.08
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine?
The IUPAC name of (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine (CID 97298159) is (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine.
What is the SMILES notation for (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine?
The canonical SMILES for (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine is N[C@H]1CCc2c(Br)cncc21.
What is the InChIKey of (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine?
The InChIKey is GBMIOQZBHUJOBP-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H9BrN2/c9-7-4-11-3-6-5(7)1-2-8(6)10/h3-4,8H,1-2,10H2/t8-/m0/s1.
What are the key properties of (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine?
(7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine has a molecular weight of 213.08 g/mol, XLogP of 1.79, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7S)-4-bromo-6,7-dihydro-5H-cyclopenta[c]pyridin-7-amine is sourced from PubChem (CID 97298159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).