2,4-dipyrrolidin-1-yl-1,3-thiazole

C11H17N3S — CID 11106975

IUPAC2,4-dipyrrolidin-1-yl-1,3-thiazole
SMILESc1sc(N2CCCC2)nc1N1CCCC1
InChIInChI=1S/C11H17N3S/c1-2-6-13(5-1)10-9-15-11(12-10)14-7-3-4-8-14/h9H,1-8H2
InChIKeySDOVVOQVYOUTLX-UHFFFAOYSA-N
MW223.34 g/mol
LogP2.34
Rot. Bonds2

About 2,4-dipyrrolidin-1-yl-1,3-thiazole

2,4-dipyrrolidin-1-yl-1,3-thiazole (PubChem CID 11106975) has the molecular formula C11H17N3S and a molecular weight of 223.34 g/mol. Its IUPAC name is 2,4-dipyrrolidin-1-yl-1,3-thiazole.

Molecular Properties

Compound Name2,4-dipyrrolidin-1-yl-1,3-thiazole
PubChem CID11106975
Molecular FormulaC11H17N3S
Molecular Weight223.34 g/mol
Exact Mass223.11
IUPAC Name2,4-dipyrrolidin-1-yl-1,3-thiazole
SMILESc1sc(N2CCCC2)nc1N1CCCC1
InChIInChI=1S/C11H17N3S/c1-2-6-13(5-1)10-9-15-11(12-10)14-7-3-4-8-14/h9H,1-8H2
InChIKeySDOVVOQVYOUTLX-UHFFFAOYSA-N
XLogP2.34
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dipyrrolidin-1-yl-1,3-thiazole?
The IUPAC name of 2,4-dipyrrolidin-1-yl-1,3-thiazole (CID 11106975) is 2,4-dipyrrolidin-1-yl-1,3-thiazole.
What is the SMILES notation for 2,4-dipyrrolidin-1-yl-1,3-thiazole?
The canonical SMILES for 2,4-dipyrrolidin-1-yl-1,3-thiazole is c1sc(N2CCCC2)nc1N1CCCC1.
What is the InChIKey of 2,4-dipyrrolidin-1-yl-1,3-thiazole?
The InChIKey is SDOVVOQVYOUTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3S/c1-2-6-13(5-1)10-9-15-11(12-10)14-7-3-4-8-14/h9H,1-8H2.
What are the key properties of 2,4-dipyrrolidin-1-yl-1,3-thiazole?
2,4-dipyrrolidin-1-yl-1,3-thiazole has a molecular weight of 223.34 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dipyrrolidin-1-yl-1,3-thiazole is sourced from PubChem (CID 11106975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).