bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone

C15H18N4OS2 — CID 151970720

IUPACbis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone
SMILESO=C(c1csc(C2CCCN2)n1)c1csc(C2CCCN2)n1
InChIInChI=1S/C15H18N4OS2/c20-13(11-7-21-14(18-11)9-3-1-5-16-9)12-8-22-15(19-12)10-4-2-6-17-10/h7-10,16-17H,1-6H2
InChIKeyUAPQNYGXQQYERJ-UHFFFAOYSA-N
MW334.47 g/mol
LogP2.68
Rot. Bonds4

About bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone

bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone (PubChem CID 151970720) has the molecular formula C15H18N4OS2 and a molecular weight of 334.47 g/mol. Its IUPAC name is bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone.

Molecular Properties

Compound Namebis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone
PubChem CID151970720
Molecular FormulaC15H18N4OS2
Molecular Weight334.47 g/mol
Exact Mass334.09
IUPAC Namebis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone
SMILESO=C(c1csc(C2CCCN2)n1)c1csc(C2CCCN2)n1
InChIInChI=1S/C15H18N4OS2/c20-13(11-7-21-14(18-11)9-3-1-5-16-9)12-8-22-15(19-12)10-4-2-6-17-10/h7-10,16-17H,1-6H2
InChIKeyUAPQNYGXQQYERJ-UHFFFAOYSA-N
XLogP2.68
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.47
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone?
The IUPAC name of bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone (CID 151970720) is bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone.
What is the SMILES notation for bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone?
The canonical SMILES for bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone is O=C(c1csc(C2CCCN2)n1)c1csc(C2CCCN2)n1.
What is the InChIKey of bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone?
The InChIKey is UAPQNYGXQQYERJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4OS2/c20-13(11-7-21-14(18-11)9-3-1-5-16-9)12-8-22-15(19-12)10-4-2-6-17-10/h7-10,16-17H,1-6H2.
What are the key properties of bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone?
bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone has a molecular weight of 334.47 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)methanone is sourced from PubChem (CID 151970720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).