N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide

C12H18N4OS — CID 29439867

IUPACN-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(c2nccs2)CC1)NC1CC1
InChIInChI=1S/C12H18N4OS/c17-11(14-10-1-2-10)9-15-4-6-16(7-5-15)12-13-3-8-18-12/h3,8,10H,1-2,4-7,9H2,(H,14,17)
InChIKeyCUMKCKPNDZPLST-UHFFFAOYSA-N
MW266.37 g/mol
LogP0.54
Rot. Bonds4

About N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide

N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide (PubChem CID 29439867) has the molecular formula C12H18N4OS and a molecular weight of 266.37 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
PubChem CID29439867
Molecular FormulaC12H18N4OS
Molecular Weight266.37 g/mol
Exact Mass266.12
IUPAC NameN-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
SMILESO=C(CN1CCN(c2nccs2)CC1)NC1CC1
InChIInChI=1S/C12H18N4OS/c17-11(14-10-1-2-10)9-15-4-6-16(7-5-15)12-13-3-8-18-12/h3,8,10H,1-2,4-7,9H2,(H,14,17)
InChIKeyCUMKCKPNDZPLST-UHFFFAOYSA-N
XLogP0.54
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-tert-butyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 51194247
N-cyclopropyl-4-(1,3-thiazol-2-yl)piperazine-1-carbothioamide
CID 115576653
N-[cyclopropyl(phenyl)methyl]-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 86919337
N-(4-acetylphenyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 17444873
N-(3,4-dichlorophenyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide
CID 18136524
N-cyclopentyl-2-[4-(1,3-thiazol-2-yloxy)piperidin-1-yl]acetamide
CID 163344746
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 52510657
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 47017403
2-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-N-cyclopropylacetamide
CID 34042322
3-(3-methylthiophen-2-yl)-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]propanamide
CID 90597292
4-phenyl-N-[1-(1,3-thiazol-2-yl)piperidin-4-yl]butanamide
CID 90597351
(2S)-N-cycloheptyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
CID 30138516

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide (CID 29439867) is N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide is O=C(CN1CCN(c2nccs2)CC1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide?
The InChIKey is CUMKCKPNDZPLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4OS/c17-11(14-10-1-2-10)9-15-4-6-16(7-5-15)12-13-3-8-18-12/h3,8,10H,1-2,4-7,9H2,(H,14,17).
What are the key properties of N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide?
N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide has a molecular weight of 266.37 g/mol, XLogP of 0.54, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]acetamide is sourced from PubChem (CID 29439867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).