(6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone

C19H19FN4OS — CID 126792102

IUPAC(6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone
SMILESCC(c1nccs1)N1CCN(C(=O)c2cnc3ccc(F)cc3c2)CC1
InChIInChI=1S/C19H19FN4OS/c1-13(18-21-4-9-26-18)23-5-7-24(8-6-23)19(25)15-10-14-11-16(20)2-3-17(14)22-12-15/h2-4,9-13H,5-8H2,1H3
InChIKeyVCFNTDRFCHRQEI-UHFFFAOYSA-N
MW370.45 g/mol
LogP3.35
Rot. Bonds3

About (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone

(6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone (PubChem CID 126792102) has the molecular formula C19H19FN4OS and a molecular weight of 370.45 g/mol. Its IUPAC name is (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Name(6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone
PubChem CID126792102
Molecular FormulaC19H19FN4OS
Molecular Weight370.45 g/mol
Exact Mass370.13
IUPAC Name(6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone
SMILESCC(c1nccs1)N1CCN(C(=O)c2cnc3ccc(F)cc3c2)CC1
InChIInChI=1S/C19H19FN4OS/c1-13(18-21-4-9-26-18)23-5-7-24(8-6-23)19(25)15-10-14-11-16(20)2-3-17(14)22-12-15/h2-4,9-13H,5-8H2,1H3
InChIKeyVCFNTDRFCHRQEI-UHFFFAOYSA-N
XLogP3.35
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-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

Related Compounds

1-[2-methyl-5-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazine-1-carbonyl]phenyl]ethanone
CID 136538141
[5-chloro-6-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133476499
(2-methylquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone
CID 126773535
(7-fluoroquinolin-3-yl)-(4-methylpiperazin-1-yl)methanone
CID 110489748
1-cyclopropyl-2-[4-(6-fluoroquinoline-3-carbonyl)piperazin-1-yl]ethanone
CID 75391181
2-[1-[4-(4-fluoro-2-nitrophenyl)piperazin-1-yl]ethyl]-1,3-thiazole
CID 133476537
4-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazine-1-carbonyl]-1H-quinolin-2-one
CID 126776288
6-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]pyrazine-2-carboxamide
CID 133476331
pyrrolidin-1-yl-[3-[1-(1,3-thiazol-2-yl)ethylamino]phenyl]methanone
CID 75498371
[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-[1-(4-fluorobenzoyl)piperidin-4-yl]methanone
CID 46612618
6-fluoro-N-(2-morpholin-4-yl-2-oxoethyl)quinoline-3-carboxamide
CID 146126137
(4-fluorophenyl)-[4-[(1R)-1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]methanone
CID 36876738

Frequently Asked Questions

What is the IUPAC name of (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone?
The IUPAC name of (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone (CID 126792102) is (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone.
What is the SMILES notation for (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone?
The canonical SMILES for (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone is CC(c1nccs1)N1CCN(C(=O)c2cnc3ccc(F)cc3c2)CC1.
What is the InChIKey of (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone?
The InChIKey is VCFNTDRFCHRQEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4OS/c1-13(18-21-4-9-26-18)23-5-7-24(8-6-23)19(25)15-10-14-11-16(20)2-3-17(14)22-12-15/h2-4,9-13H,5-8H2,1H3.
What are the key properties of (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone?
(6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone has a molecular weight of 370.45 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoroquinolin-3-yl)-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]methanone is sourced from PubChem (CID 126792102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).