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

C10H16N4OS — CID 18136601

IUPAC2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
SMILESCC(C(N)=O)N1CCN(c2nccs2)CC1
InChIInChI=1S/C10H16N4OS/c1-8(9(11)15)13-3-5-14(6-4-13)10-12-2-7-16-10/h2,7-8H,3-6H2,1H3,(H2,11,15)
InChIKeyILRUBHBWTFTHTH-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.14
Rot. Bonds3

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

2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide (PubChem CID 18136601) has the molecular formula C10H16N4OS and a molecular weight of 240.33 g/mol. Its IUPAC name is 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide.

Molecular Properties

Compound Name2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
PubChem CID18136601
Molecular FormulaC10H16N4OS
Molecular Weight240.33 g/mol
Exact Mass240.10
IUPAC Name2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
SMILESCC(C(N)=O)N1CCN(c2nccs2)CC1
InChIInChI=1S/C10H16N4OS/c1-8(9(11)15)13-3-5-14(6-4-13)10-12-2-7-16-10/h2,7-8H,3-6H2,1H3,(H2,11,15)
InChIKeyILRUBHBWTFTHTH-UHFFFAOYSA-N
XLogP0.14
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-cycloheptyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
CID 30138516
(2R)-N-tert-butyl-2-[4-(1,3-thiazol-2-yl)-1,4-diazepan-1-yl]propanamide
CID 94796371
N-prop-2-ynyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
CID 86919342
N-(4-sulfamoylphenyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
CID 55499702
N-(4-ethylphenyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
CID 51311966
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentanoic acid
CID 83042107
2-amino-4-methyl-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentan-1-one
CID 24708603
ethyl 2,4-dimethyl-5-[2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanoyl]-1H-pyrrole-3-carboxylate
CID 18136609
1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-2-ol
CID 60885531
2-(propan-2-ylamino)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]ethanone
CID 60841085
N-benzyl-N-(2-phenylethyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
CID 42931498
(2S)-N-(2-chlorophenyl)-2-[4-(1,3-thiazol-2-yl)-1,4-diazepan-1-yl]propanamide
CID 52507095

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide?
The IUPAC name of 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide (CID 18136601) is 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide.
What is the SMILES notation for 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide?
The canonical SMILES for 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide is CC(C(N)=O)N1CCN(c2nccs2)CC1.
What is the InChIKey of 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide?
The InChIKey is ILRUBHBWTFTHTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4OS/c1-8(9(11)15)13-3-5-14(6-4-13)10-12-2-7-16-10/h2,7-8H,3-6H2,1H3,(H2,11,15).
What are the key properties of 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide?
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide has a molecular weight of 240.33 g/mol, XLogP of 0.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide is sourced from PubChem (CID 18136601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).