2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine

C9H13BrN2 — CID 83911428

IUPAC2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine
SMILESNCCC1CCc2c1c[nH]c2Br
InChIInChI=1S/C9H13BrN2/c10-9-7-2-1-6(3-4-11)8(7)5-12-9/h5-6,12H,1-4,11H2
InChIKeyFVMTVDVSLZTNBL-UHFFFAOYSA-N
MW229.12 g/mol
LogP2.16
Rot. Bonds2

About 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine

2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine (PubChem CID 83911428) has the molecular formula C9H13BrN2 and a molecular weight of 229.12 g/mol. Its IUPAC name is 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine.

Molecular Properties

Compound Name2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine
PubChem CID83911428
Molecular FormulaC9H13BrN2
Molecular Weight229.12 g/mol
Exact Mass228.03
IUPAC Name2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine
SMILESNCCC1CCc2c1c[nH]c2Br
InChIInChI=1S/C9H13BrN2/c10-9-7-2-1-6(3-4-11)8(7)5-12-9/h5-6,12H,1-4,11H2
InChIKeyFVMTVDVSLZTNBL-UHFFFAOYSA-N
XLogP2.16
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.12
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine with MolForge

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

Launch Full Analysis

Related Compounds

2-(1,4,5,6-tetrahydrocyclopenta[b]pyrrol-4-yl)ethanamine
CID 82417410
3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrole-6-carboxylic acid
CID 83911522
2-(3-chloro-2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrrol-6-yl)ethanamine
CID 83908221
2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-4-yl)ethanamine
CID 83861633
(1-chloro-4,5,6,7-tetrahydro-2H-isoindol-4-yl)methanamine
CID 83906902
3-(2-aminoethyl)-2,3-dihydro-1H-inden-5-ol
CID 83827747
5-(2-aminoethyl)-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one
CID 83861735
2-(2-chloro-5,6-dihydro-4H-cyclopenta[b]furan-4-yl)ethanamine
CID 83906976
2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine
CID 83843148
2-(1-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-yl)ethanamine
CID 83861581
2-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine
CID 83907867
2-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-6-yl)ethanamine
CID 83872534

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine?
The IUPAC name of 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine (CID 83911428) is 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine.
What is the SMILES notation for 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine?
The canonical SMILES for 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine is NCCC1CCc2c1c[nH]c2Br.
What is the InChIKey of 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine?
The InChIKey is FVMTVDVSLZTNBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13BrN2/c10-9-7-2-1-6(3-4-11)8(7)5-12-9/h5-6,12H,1-4,11H2.
What are the key properties of 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine?
2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine has a molecular weight of 229.12 g/mol, XLogP of 2.16, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-6-yl)ethanamine is sourced from PubChem (CID 83911428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).