(3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone

C15H24N4OS — CID 119886774

IUPAC(3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone
SMILESCCc1cnc(N2CCN(C(=O)C3CCC(N)C3)CC2)s1
InChIInChI=1S/C15H24N4OS/c1-2-13-10-17-15(21-13)19-7-5-18(6-8-19)14(20)11-3-4-12(16)9-11/h10-12H,2-9,16H2,1H3
InChIKeyWGVIMWQSUJUCFU-UHFFFAOYSA-N
MW308.45 g/mol
LogP1.48
Rot. Bonds3

About (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone

(3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone (PubChem CID 119886774) has the molecular formula C15H24N4OS and a molecular weight of 308.45 g/mol. Its IUPAC name is (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone
PubChem CID119886774
Molecular FormulaC15H24N4OS
Molecular Weight308.45 g/mol
Exact Mass308.17
IUPAC Name(3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone
SMILESCCc1cnc(N2CCN(C(=O)C3CCC(N)C3)CC2)s1
InChIInChI=1S/C15H24N4OS/c1-2-13-10-17-15(21-13)19-7-5-18(6-8-19)14(20)11-3-4-12(16)9-11/h10-12H,2-9,16H2,1H3
InChIKeyWGVIMWQSUJUCFU-UHFFFAOYSA-N
XLogP1.48
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.45
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]-(4-hydroxypyrrolidin-2-yl)methanone
CID 119886786
2-amino-1-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]-2-(oxan-4-yl)ethanone;dihydrochloride
CID 120800589
(3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 66009185
(3-aminocyclohexyl)-[4-(3-methyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]methanone
CID 119894220
2-(4-aminophenyl)-1-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanone
CID 119886766
(1-aminocyclohexyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone;dihydrochloride
CID 119886813
[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120941808
cyclopropyl-[4-(5-methyl-1,3-thiazol-2-yl)-1,4-diazepan-1-yl]methanone
CID 165434688
[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]-(4-fluorophenyl)methanone
CID 136528222
(3-aminocyclopentyl)-[4-(5-bromo-2-pyridinyl)piperazin-1-yl]methanone
CID 66009179
[(1S,3S)-3-aminocyclopentyl]-pyrrolidin-1-ylmethanone
CID 97030843
(3-aminocyclopentyl)-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]methanone
CID 119881362

Frequently Asked Questions

What is the IUPAC name of (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The IUPAC name of (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone (CID 119886774) is (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone.
What is the SMILES notation for (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The canonical SMILES for (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone is CCc1cnc(N2CCN(C(=O)C3CCC(N)C3)CC2)s1.
What is the InChIKey of (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone?
The InChIKey is WGVIMWQSUJUCFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4OS/c1-2-13-10-17-15(21-13)19-7-5-18(6-8-19)14(20)11-3-4-12(16)9-11/h10-12H,2-9,16H2,1H3.
What are the key properties of (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone?
(3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone has a molecular weight of 308.45 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminocyclopentyl)-[4-(5-ethyl-1,3-thiazol-2-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 119886774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).