4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide

C11H18N4O2 — CID 66336168

IUPAC4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide
SMILESCc1cnoc1C(=O)NCCN1CCNCC1
InChIInChI=1S/C11H18N4O2/c1-9-8-14-17-10(9)11(16)13-4-7-15-5-2-12-3-6-15/h8,12H,2-7H2,1H3,(H,13,16)
InChIKeyGNEDBCXHNYXKRK-UHFFFAOYSA-N
MW238.29 g/mol
LogP-0.38
Rot. Bonds4

About 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide

4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide (PubChem CID 66336168) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide
PubChem CID66336168
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide
SMILESCc1cnoc1C(=O)NCCN1CCNCC1
InChIInChI=1S/C11H18N4O2/c1-9-8-14-17-10(9)11(16)13-4-7-15-5-2-12-3-6-15/h8,12H,2-7H2,1H3,(H,13,16)
InChIKeyGNEDBCXHNYXKRK-UHFFFAOYSA-N
XLogP-0.38
TPSA70.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-N-(2-piperazin-1-ylethyl)pyridine-3-carboxamide
CID 43600318
3-bromo-4-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 81471524
3-methyl-N-(2-piperazin-1-ylethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 119446105
2,5-dimethyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide
CID 66127121
2,5-dimethyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide;hydrochloride
CID 119447776
5-ethyl-4-methyl-N-(2-piperazin-1-ylethyl)furan-2-carboxamide
CID 119446544
4-[(4-methyl-1,2-oxazole-5-carbonyl)amino]butanoic acid
CID 66334475
2-methyl-N-(2-piperazin-1-ylethyl)-5-sulfanylbenzamide
CID 107024052
2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide
CID 66128465
4-(methylaminomethyl)-N-(2-piperazin-1-ylethyl)benzamide
CID 90338095
2-(2,5-dimethylphenyl)-N-(2-piperazin-1-ylethyl)acetamide
CID 62537843
3-methyl-N-(3-piperazin-1-ylpropyl)-1,2-oxazole-5-carboxamide;hydrochloride
CID 119394236

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide (CID 66336168) is 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide is Cc1cnoc1C(=O)NCCN1CCNCC1.
What is the InChIKey of 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide?
The InChIKey is GNEDBCXHNYXKRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-9-8-14-17-10(9)11(16)13-4-7-15-5-2-12-3-6-15/h8,12H,2-7H2,1H3,(H,13,16).
What are the key properties of 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide?
4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide has a molecular weight of 238.29 g/mol, XLogP of -0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-piperazin-1-ylethyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 66336168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).