[2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone

C10H16N4OS — CID 82515115

IUPAC[2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone
SMILESCN(C)c1nc(C(=O)N2CCNCC2)cs1
InChIInChI=1S/C10H16N4OS/c1-13(2)10-12-8(7-16-10)9(15)14-5-3-11-4-6-14/h7,11H,3-6H2,1-2H3
InChIKeyAECCUFCOKIRJJB-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.25
Rot. Bonds2

About [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone

[2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone (PubChem CID 82515115) has the molecular formula C10H16N4OS and a molecular weight of 240.33 g/mol. Its IUPAC name is [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone.

Molecular Properties

Compound Name[2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone
PubChem CID82515115
Molecular FormulaC10H16N4OS
Molecular Weight240.33 g/mol
Exact Mass240.10
IUPAC Name[2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone
SMILESCN(C)c1nc(C(=O)N2CCNCC2)cs1
InChIInChI=1S/C10H16N4OS/c1-13(2)10-12-8(7-16-10)9(15)14-5-3-11-4-6-14/h7,11H,3-6H2,1-2H3
InChIKeyAECCUFCOKIRJJB-UHFFFAOYSA-N
XLogP0.25
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(methylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone
CID 82509879
2-[4-(piperazine-1-carbonyl)-1,3-thiazol-2-yl]acetonitrile
CID 82510699
[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone;hydrochloride
CID 119401434
[2-(furan-2-yl)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone
CID 82515785
piperazin-1-yl-[2-(4-propan-2-yloxyphenyl)-1,3-thiazol-4-yl]methanone
CID 119402859
1,4-diazepan-1-yl(thiadiazol-4-yl)methanone
CID 65214276
1,4-diazepan-1-yl-[2-(furan-3-yl)-1,3-thiazol-4-yl]methanone
CID 119418759
N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)-1,3-thiazole-4-carboxamide
CID 65198629
1,4-diazepan-1-yl-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-4-yl]methanone
CID 119415859
piperazin-1-yl(1,2,5-thiadiazol-3-yl)methanone
CID 43522513
1-[4-(2-methyl-1,3-thiazole-4-carbonyl)piperazin-1-yl]ethanone
CID 47445163
6-methyl-4-(piperazine-1-carbonyl)-1H-pyrimidin-2-one
CID 82509419

Frequently Asked Questions

What is the IUPAC name of [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone?
The IUPAC name of [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone (CID 82515115) is [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone.
What is the SMILES notation for [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone?
The canonical SMILES for [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone is CN(C)c1nc(C(=O)N2CCNCC2)cs1.
What is the InChIKey of [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone?
The InChIKey is AECCUFCOKIRJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4OS/c1-13(2)10-12-8(7-16-10)9(15)14-5-3-11-4-6-14/h7,11H,3-6H2,1-2H3.
What are the key properties of [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone?
[2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone has a molecular weight of 240.33 g/mol, XLogP of 0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(dimethylamino)-1,3-thiazol-4-yl]-piperazin-1-ylmethanone is sourced from PubChem (CID 82515115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).