1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride

C11H17ClN2S — CID 130747704

IUPAC1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride
SMILESCl.c1cc(C2CCCN2C2CNC2)cs1
InChIInChI=1S/C11H16N2S.ClH/c1-2-11(9-3-5-14-8-9)13(4-1)10-6-12-7-10;/h3,5,8,10-12H,1-2,4,6-7H2;1H
InChIKeyVIEKYFGWIJBXND-UHFFFAOYSA-N
MW244.79 g/mol
LogP2.28
Rot. Bonds2

About 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride

1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride (PubChem CID 130747704) has the molecular formula C11H17ClN2S and a molecular weight of 244.79 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride.

Molecular Properties

Compound Name1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride
PubChem CID130747704
Molecular FormulaC11H17ClN2S
Molecular Weight244.79 g/mol
Exact Mass244.08
IUPAC Name1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride
SMILESCl.c1cc(C2CCCN2C2CNC2)cs1
InChIInChI=1S/C11H16N2S.ClH/c1-2-11(9-3-5-14-8-9)13(4-1)10-6-12-7-10;/h3,5,8,10-12H,1-2,4,6-7H2;1H
InChIKeyVIEKYFGWIJBXND-UHFFFAOYSA-N
XLogP2.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.79
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride 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

[1-(azetidin-3-yl)triazol-4-yl]-(2-thiophen-3-ylpyrrolidin-1-yl)methanone
CID 79318877
(2R)-1-propan-2-yl-2-thiophen-3-ylpyrrolidine
CID 124500963
3-thiophen-3-ylpyrrolidine;hydrochloride
CID 169498224
(2R)-1-(cyclohexylmethyl)-2-thiophen-3-ylpyrrolidine
CID 51946772
cyclopropyl-[(2R)-2-thiophen-3-ylpyrrolidin-1-yl]methanone
CID 94117667
2-[(3S)-pyrrolidin-3-yl]-1-(2-thiophen-3-ylpyrrolidin-1-yl)ethanone
CID 154840235
(5S)-5-[(2S)-2-thiophen-3-ylpyrrolidine-1-carbonyl]piperidin-2-one
CID 94171138
2,2-dimethyl-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one
CID 64591656
3-(2-thiophen-3-ylpyrrolidin-1-yl)propanoic acid
CID 119134694
piperidin-2-yl-(2-thiophen-3-ylpyrrolidin-1-yl)methanone
CID 54871703
N,N-dimethyl-2-[(2S)-2-thiophen-3-ylpyrrolidin-1-yl]acetamide
CID 94087259
phenyl-(2-thiophen-3-ylpyrrolidin-1-yl)methanone
CID 60770024

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride?
The IUPAC name of 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride (CID 130747704) is 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride.
What is the SMILES notation for 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride?
The canonical SMILES for 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride is Cl.c1cc(C2CCCN2C2CNC2)cs1.
What is the InChIKey of 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride?
The InChIKey is VIEKYFGWIJBXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2S.ClH/c1-2-11(9-3-5-14-8-9)13(4-1)10-6-12-7-10;/h3,5,8,10-12H,1-2,4,6-7H2;1H.
What are the key properties of 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride?
1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride has a molecular weight of 244.79 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-2-thiophen-3-ylpyrrolidine;hydrochloride is sourced from PubChem (CID 130747704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).