2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide

C11H18N4O2 — CID 71877060

IUPAC2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide
SMILESCc1cc(NC(=O)N2CCN(C)CC2C)on1
InChIInChI=1S/C11H18N4O2/c1-8-6-10(17-13-8)12-11(16)15-5-4-14(3)7-9(15)2/h6,9H,4-5,7H2,1-3H3,(H,12,16)
InChIKeyLVHISRWCMKKCQL-UHFFFAOYSA-N
MW238.29 g/mol
LogP1.15
Rot. Bonds1

About 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide

2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide (PubChem CID 71877060) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide
PubChem CID71877060
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide
SMILESCc1cc(NC(=O)N2CCN(C)CC2C)on1
InChIInChI=1S/C11H18N4O2/c1-8-6-10(17-13-8)12-11(16)15-5-4-14(3)7-9(15)2/h6,9H,4-5,7H2,1-3H3,(H,12,16)
InChIKeyLVHISRWCMKKCQL-UHFFFAOYSA-N
XLogP1.15
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide?
The IUPAC name of 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide (CID 71877060) is 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide is Cc1cc(NC(=O)N2CCN(C)CC2C)on1.
What is the InChIKey of 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide?
The InChIKey is LVHISRWCMKKCQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-8-6-10(17-13-8)12-11(16)15-5-4-14(3)7-9(15)2/h6,9H,4-5,7H2,1-3H3,(H,12,16).
What are the key properties of 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide?
2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide is sourced from PubChem (CID 71877060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).