N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide

C8H15N3O2 — CID 89097126

IUPACN-ethyl-4-methyl-3-oxopiperazine-1-carboxamide
SMILESCCNC(=O)N1CCN(C)C(=O)C1
InChIInChI=1S/C8H15N3O2/c1-3-9-8(13)11-5-4-10(2)7(12)6-11/h3-6H2,1-2H3,(H,9,13)
InChIKeyMQSUDBYLLMWIOY-UHFFFAOYSA-N
MW185.23 g/mol
LogP-0.51
Rot. Bonds1

About N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide

N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide (PubChem CID 89097126) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-methyl-3-oxopiperazine-1-carboxamide
PubChem CID89097126
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC NameN-ethyl-4-methyl-3-oxopiperazine-1-carboxamide
SMILESCCNC(=O)N1CCN(C)C(=O)C1
InChIInChI=1S/C8H15N3O2/c1-3-9-8(13)11-5-4-10(2)7(12)6-11/h3-6H2,1-2H3,(H,9,13)
InChIKeyMQSUDBYLLMWIOY-UHFFFAOYSA-N
XLogP-0.51
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-3-oxo-N-(2,2,2-trifluoroethyl)piperazine-1-carboxamide
CID 115643195
2-[(4-methyl-3-oxopiperazine-1-carbonyl)amino]butanoic acid
CID 64694323
1-methyl-4-propanoylpiperazin-2-one
CID 64693548
2-hydroxy-4-[(4-methyl-3-oxopiperazine-1-carbonyl)amino]butanoic acid
CID 114007573
4-butanoyl-1-methylpiperazin-2-one
CID 64693337
1-(4-methyl-3-oxopiperazin-1-yl)butane-1,3-dione
CID 64680135
ethane;N-ethyl-4-methylpiperazine-1-carboxamide
CID 162757758
N-ethyl-2-(4-methyl-3-oxopiperazin-1-yl)acetamide
CID 166062321
(2S)-2-[(4-methyl-3-oxopiperazine-1-carbonyl)amino]pentanedioic acid
CID 64695756
4-[[(4-methyl-3-oxopiperazine-1-carbonyl)amino]methyl]oxane-4-carboxylic acid
CID 115440582
N-ethyl-3-oxopiperazine-1-carboxamide
CID 53017572
2-methyl-2-[(4-methyl-3-oxopiperazine-1-carbonyl)amino]propanoic acid
CID 64693067

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide?
The IUPAC name of N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide (CID 89097126) is N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide.
What is the SMILES notation for N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide?
The canonical SMILES for N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide is CCNC(=O)N1CCN(C)C(=O)C1.
What is the InChIKey of N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide?
The InChIKey is MQSUDBYLLMWIOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-3-9-8(13)11-5-4-10(2)7(12)6-11/h3-6H2,1-2H3,(H,9,13).
What are the key properties of N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide?
N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide has a molecular weight of 185.23 g/mol, XLogP of -0.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-3-oxopiperazine-1-carboxamide is sourced from PubChem (CID 89097126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).