(4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone

C12H16N4OS — CID 110850018

IUPAC(4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone
SMILESCCN1CCN(C(=O)c2csc3nccn23)CC1
InChIInChI=1S/C12H16N4OS/c1-2-14-5-7-15(8-6-14)11(17)10-9-18-12-13-3-4-16(10)12/h3-4,9H,2,5-8H2,1H3
InChIKeyZNSUHAYIGWXSRF-UHFFFAOYSA-N
MW264.35 g/mol
LogP1.17
Rot. Bonds2

About (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone

(4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone (PubChem CID 110850018) has the molecular formula C12H16N4OS and a molecular weight of 264.35 g/mol. Its IUPAC name is (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone.

Molecular Properties

Compound Name(4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone
PubChem CID110850018
Molecular FormulaC12H16N4OS
Molecular Weight264.35 g/mol
Exact Mass264.10
IUPAC Name(4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone
SMILESCCN1CCN(C(=O)c2csc3nccn23)CC1
InChIInChI=1S/C12H16N4OS/c1-2-14-5-7-15(8-6-14)11(17)10-9-18-12-13-3-4-16(10)12/h3-4,9H,2,5-8H2,1H3
InChIKeyZNSUHAYIGWXSRF-UHFFFAOYSA-N
XLogP1.17
TPSA40.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(4-ethylpiperazin-1-yl)-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-3-yl)methanone
CID 166351541
(4-ethylpiperazin-1-yl)-(4-sulfanylthiophen-2-yl)methanone
CID 107021585
[2-(4-ethylpiperazine-1-carbonyl)-4-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 109081659
3-[4-(4-ethylpiperazine-1-carbonyl)thiophen-2-yl]prop-2-enoic acid
CID 79684571
[2-(4-ethylpiperazine-1-carbonyl)-4-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109084137
(4-ethylpiperazin-1-yl)-pyrido[2,3-b]pyrazin-8-ylmethanone
CID 139018091
(4-ethylpiperazin-1-yl)-(2-methyltriazol-4-yl)methanone
CID 110691366
(5-chlorothiophen-2-yl)-(4-ethylpiperazin-1-yl)methanone
CID 25236154
azepan-1-yl-[1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrol-2-yl]methanone
CID 20937035
(4-amino-3-pyridin-2-yl-1,2-thiazol-5-yl)-(4-ethylpiperazin-1-yl)methanone
CID 53141252
[6-[(Z)-but-2-enyl]thieno[2,3-b]pyrrol-5-yl]-(4-ethylpiperazin-1-yl)methanone
CID 7288350
azepan-1-yl-[4-(4-ethylpiperazin-1-yl)-2-pyridinyl]methanone
CID 109208613

Frequently Asked Questions

What is the IUPAC name of (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone?
The IUPAC name of (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone (CID 110850018) is (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone.
What is the SMILES notation for (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone?
The canonical SMILES for (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone is CCN1CCN(C(=O)c2csc3nccn23)CC1.
What is the InChIKey of (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone?
The InChIKey is ZNSUHAYIGWXSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4OS/c1-2-14-5-7-15(8-6-14)11(17)10-9-18-12-13-3-4-16(10)12/h3-4,9H,2,5-8H2,1H3.
What are the key properties of (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone?
(4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone has a molecular weight of 264.35 g/mol, XLogP of 1.17, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylpiperazin-1-yl)-imidazo[2,1-b][1,3]thiazol-3-ylmethanone is sourced from PubChem (CID 110850018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).