[1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine

C12H20N2S — CID 115311578

IUPAC[1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine
SMILESCCC(c1cccs1)N1CCCC1CN
InChIInChI=1S/C12H20N2S/c1-2-11(12-6-4-8-15-12)14-7-3-5-10(14)9-13/h4,6,8,10-11H,2-3,5,7,9,13H2,1H3
InChIKeyVAJWYUJGOAXFLI-UHFFFAOYSA-N
MW224.37 g/mol
LogP2.62
Rot. Bonds4

About [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine

[1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine (PubChem CID 115311578) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine
PubChem CID115311578
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name[1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine
SMILESCCC(c1cccs1)N1CCCC1CN
InChIInChI=1S/C12H20N2S/c1-2-11(12-6-4-8-15-12)14-7-3-5-10(14)9-13/h4,6,8,10-11H,2-3,5,7,9,13H2,1H3
InChIKeyVAJWYUJGOAXFLI-UHFFFAOYSA-N
XLogP2.62
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2-methyl-1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine
CID 115311559
[1-[cyclopropyl(thiophen-2-yl)methyl]pyrrolidin-2-yl]methanamine
CID 115311689
[1-(1-phenylpropyl)pyrrolidin-2-yl]methanamine
CID 115311606
1-(1-thiophen-2-ylpropyl)pyrrolidine-2-carboxylic acid
CID 4038004
1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine
CID 103975639
2-[1-(2-amino-1-thiophen-2-ylethyl)piperidin-2-yl]ethanol
CID 55021562
[1-[1-(2-fluorophenyl)propyl]piperidin-2-yl]methanamine
CID 112679200
3-(2-ethylpiperidin-1-yl)-3-thiophen-2-ylpropanoic acid
CID 82134042
2-[1-[2-(aminomethyl)pyrrolidin-1-yl]propyl]-4-bromophenol
CID 113284186
N,2,3-trimethyl-1-(1-thiophen-2-ylpropyl)piperidin-4-amine
CID 79406850
2-ethyl-5-propan-2-yl-1-(1-thiophen-2-ylpropyl)piperazine
CID 64937948
(1-propan-2-ylpyrrolidin-2-yl)methanamine
CID 2762717

Frequently Asked Questions

What is the IUPAC name of [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine?
The IUPAC name of [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine (CID 115311578) is [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine?
The canonical SMILES for [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine is CCC(c1cccs1)N1CCCC1CN.
What is the InChIKey of [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine?
The InChIKey is VAJWYUJGOAXFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-2-11(12-6-4-8-15-12)14-7-3-5-10(14)9-13/h4,6,8,10-11H,2-3,5,7,9,13H2,1H3.
What are the key properties of [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine?
[1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine has a molecular weight of 224.37 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 115311578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).