2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

C18H23N5S — CID 126893609

IUPAC2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESc1ccc(N2CCN(C3CN(c4nc5c(s4)CCC5)C3)CC2)nc1
InChIInChI=1S/C18H23N5S/c1-2-7-19-17(6-1)22-10-8-21(9-11-22)14-12-23(13-14)18-20-15-4-3-5-16(15)24-18/h1-2,6-7,14H,3-5,8-13H2
InChIKeyYYOMAZDWKGMEDV-UHFFFAOYSA-N
MW341.48 g/mol
LogP2.04
Rot. Bonds3

About 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (PubChem CID 126893609) has the molecular formula C18H23N5S and a molecular weight of 341.48 g/mol. Its IUPAC name is 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.

Molecular Properties

Compound Name2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
PubChem CID126893609
Molecular FormulaC18H23N5S
Molecular Weight341.48 g/mol
Exact Mass341.17
IUPAC Name2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESc1ccc(N2CCN(C3CN(c4nc5c(s4)CCC5)C3)CC2)nc1
InChIInChI=1S/C18H23N5S/c1-2-7-19-17(6-1)22-10-8-21(9-11-22)14-12-23(13-14)18-20-15-4-3-5-16(15)24-18/h1-2,6-7,14H,3-5,8-13H2
InChIKeyYYOMAZDWKGMEDV-UHFFFAOYSA-N
XLogP2.04
TPSA35.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.48
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole with MolForge

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Related Compounds

2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 171335389
1-(1-cyclohexylazetidin-3-yl)-4-pyridin-2-ylpiperazine
CID 126893395
3-(4-pyridin-2-ylpiperazin-1-yl)azetidine-1-carbaldehyde
CID 123583794
2-cyclobutyl-4-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine
CID 126893632
2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 126893638
1-[1-(3-chloro-4-pyridinyl)azetidin-3-yl]-4-pyridin-2-ylpiperazine
CID 126893375
1-pyridin-2-yl-4-(1-pyrrolidin-1-ylsulfonylazetidin-3-yl)piperazine
CID 126893363
4,5-dimethyl-2-(4-pyridin-2-ylpiperazin-1-yl)-1,3-thiazole
CID 171335410
1-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]sulfonylazepane
CID 126893450
(3R,4R)-1-(1,3-benzothiazol-2-yl)-4-(4-pyridin-2-ylpiperazin-1-yl)pyrrolidin-3-ol
CID 133118551
4-(4-pyridin-2-ylpiperazin-1-yl)cyclohexan-1-amine
CID 15045421
1-pyridin-2-yl-4-[1-[2-(triazol-2-yl)ethyl]azetidin-3-yl]piperazine
CID 126893461

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The IUPAC name of 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (CID 126893609) is 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.
What is the SMILES notation for 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The canonical SMILES for 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is c1ccc(N2CCN(C3CN(c4nc5c(s4)CCC5)C3)CC2)nc1.
What is the InChIKey of 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The InChIKey is YYOMAZDWKGMEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5S/c1-2-7-19-17(6-1)22-10-8-21(9-11-22)14-12-23(13-14)18-20-15-4-3-5-16(15)24-18/h1-2,6-7,14H,3-5,8-13H2.
What are the key properties of 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole has a molecular weight of 341.48 g/mol, XLogP of 2.04, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is sourced from PubChem (CID 126893609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).