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

C15H22N4O3S — CID 17401099

IUPACN-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide
SMILESCc1csc(=O)n1CC(=O)N1CCN(CC(=O)NC2CC2)CC1
InChIInChI=1S/C15H22N4O3S/c1-11-10-23-15(22)19(11)9-14(21)18-6-4-17(5-7-18)8-13(20)16-12-2-3-12/h10,12H,2-9H2,1H3,(H,16,20)
InChIKeyDYESUESIMMKCFI-UHFFFAOYSA-N
MW338.43 g/mol
LogP-0.36
Rot. Bonds5

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

N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide (PubChem CID 17401099) has the molecular formula C15H22N4O3S and a molecular weight of 338.43 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide
PubChem CID17401099
Molecular FormulaC15H22N4O3S
Molecular Weight338.43 g/mol
Exact Mass338.14
IUPAC NameN-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide
SMILESCc1csc(=O)n1CC(=O)N1CCN(CC(=O)NC2CC2)CC1
InChIInChI=1S/C15H22N4O3S/c1-11-10-23-15(22)19(11)9-14(21)18-6-4-17(5-7-18)8-13(20)16-12-2-3-12/h10,12H,2-9H2,1H3,(H,16,20)
InChIKeyDYESUESIMMKCFI-UHFFFAOYSA-N
XLogP-0.36
TPSA74.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide (CID 17401099) is N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide is Cc1csc(=O)n1CC(=O)N1CCN(CC(=O)NC2CC2)CC1.
What is the InChIKey of N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide?
The InChIKey is DYESUESIMMKCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O3S/c1-11-10-23-15(22)19(11)9-14(21)18-6-4-17(5-7-18)8-13(20)16-12-2-3-12/h10,12H,2-9H2,1H3,(H,16,20).
What are the key properties of N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide?
N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide has a molecular weight of 338.43 g/mol, XLogP of -0.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 17401099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).