1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine

C13H22N2S — CID 103975639

IUPAC1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine
SMILESCCC(c1cccs1)N1CCC(C(C)N)C1
InChIInChI=1S/C13H22N2S/c1-3-12(13-5-4-8-16-13)15-7-6-11(9-15)10(2)14/h4-5,8,10-12H,3,6-7,9,14H2,1-2H3
InChIKeyOEVZQNGXRWNVLZ-UHFFFAOYSA-N
MW238.40 g/mol
LogP2.87
Rot. Bonds4

About 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine

1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine (PubChem CID 103975639) has the molecular formula C13H22N2S and a molecular weight of 238.40 g/mol. Its IUPAC name is 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine
PubChem CID103975639
Molecular FormulaC13H22N2S
Molecular Weight238.40 g/mol
Exact Mass238.15
IUPAC Name1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine
SMILESCCC(c1cccs1)N1CCC(C(C)N)C1
InChIInChI=1S/C13H22N2S/c1-3-12(13-5-4-8-16-13)15-7-6-11(9-15)10(2)14/h4-5,8,10-12H,3,6-7,9,14H2,1-2H3
InChIKeyOEVZQNGXRWNVLZ-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-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

N,3-dimethyl-1-(1-thiophen-2-ylpropyl)piperidin-4-amine
CID 54976100
[1-(1-thiophen-2-ylpropyl)pyrrolidin-2-yl]methanamine
CID 115311578
1-[1-(1-phenylpropyl)piperidin-3-yl]ethanamine;hydrochloride
CID 119925499
2-[1-(1-thiophen-2-ylpropyl)piperidin-4-yl]acetic acid
CID 79606686
3-cyclohexyl-1-(1-thiophen-2-ylpropyl)-1,4-diazepane
CID 64942493
1-(2-amino-1-thiophen-2-ylethyl)pyrrolidin-3-ol
CID 62941144
2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-2-thiophen-2-ylethanamine
CID 79174673
1-[1-(1-thiophen-2-ylpropyl)azetidin-3-yl]piperazine
CID 66202216
2-methyl-2-[1-(1-thiophen-2-ylpropyl)piperidin-3-yl]propanoic acid
CID 83198545
(1R)-1-[(3R)-1-propan-2-ylpyrrolidin-3-yl]ethanamine
CID 140940785
1-[1-[1-(4-methylphenyl)propyl]piperidin-4-yl]ethanamine
CID 55216289
N-[[1-(1-thiophen-2-ylbutyl)pyrrolidin-3-yl]methyl]ethanamine
CID 62511490

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine?
The IUPAC name of 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine (CID 103975639) is 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine.
What is the SMILES notation for 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine?
The canonical SMILES for 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine is CCC(c1cccs1)N1CCC(C(C)N)C1.
What is the InChIKey of 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine?
The InChIKey is OEVZQNGXRWNVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2S/c1-3-12(13-5-4-8-16-13)15-7-6-11(9-15)10(2)14/h4-5,8,10-12H,3,6-7,9,14H2,1-2H3.
What are the key properties of 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine?
1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine has a molecular weight of 238.40 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-thiophen-2-ylpropyl)pyrrolidin-3-yl]ethanamine is sourced from PubChem (CID 103975639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).