[2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine

C16H24N2 — CID 115560349

IUPAC[2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine
SMILESNCc1ccccc1CCN1CC2CCCC2C1
InChIInChI=1S/C16H24N2/c17-10-14-5-2-1-4-13(14)8-9-18-11-15-6-3-7-16(15)12-18/h1-2,4-5,15-16H,3,6-12,17H2
InChIKeyVTUUAMLHVJJSHR-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.42
Rot. Bonds4

About [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine

[2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine (PubChem CID 115560349) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine.

Molecular Properties

Compound Name[2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine
PubChem CID115560349
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name[2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine
SMILESNCc1ccccc1CCN1CC2CCCC2C1
InChIInChI=1S/C16H24N2/c17-10-14-5-2-1-4-13(14)8-9-18-11-15-6-3-7-16(15)12-18/h1-2,4-5,15-16H,3,6-12,17H2
InChIKeyVTUUAMLHVJJSHR-UHFFFAOYSA-N
XLogP2.42
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine 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-[2-(3-ethylpyrrolidin-1-yl)ethyl]phenyl]methanamine
CID 113417886
[2-[2-[3-(methoxymethyl)piperidin-1-yl]ethyl]phenyl]methanamine
CID 106587342
[2-(3-azabicyclo[3.3.1]nonan-3-ylmethyl)phenyl]methanamine
CID 114196298
4-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]aniline
CID 113335546
[2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]phenyl]methanamine
CID 81322728
carbanide;ethane;2-(2-phenylethyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;tungsten;yttrium
CID 159349372
[2-[2-(3-propoxypiperidin-1-yl)ethyl]phenyl]methanamine
CID 81322503
2-[(3aS,6aR)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]ethanamine
CID 98010112
[2-[2-(2-ethylmorpholin-4-yl)ethyl]phenyl]methanamine
CID 81321825
[2-[2-(2-methylazepan-1-yl)ethyl]phenyl]methanamine
CID 81321986
3-[2-(2-bromophenyl)ethyl]-3-azabicyclo[3.1.0]hexane
CID 83825905
[2-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]phenyl]methanamine
CID 81322429

Frequently Asked Questions

What is the IUPAC name of [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine?
The IUPAC name of [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine (CID 115560349) is [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine.
What is the SMILES notation for [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine?
The canonical SMILES for [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine is NCc1ccccc1CCN1CC2CCCC2C1.
What is the InChIKey of [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine?
The InChIKey is VTUUAMLHVJJSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c17-10-14-5-2-1-4-13(14)8-9-18-11-15-6-3-7-16(15)12-18/h1-2,4-5,15-16H,3,6-12,17H2.
What are the key properties of [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine?
[2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine has a molecular weight of 244.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)ethyl]phenyl]methanamine is sourced from PubChem (CID 115560349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).