N-(methylcarbamoyl)piperazine-2-carboxamide

C7H14N4O2 — CID 70071531

IUPACN-(methylcarbamoyl)piperazine-2-carboxamide
SMILESCNC(=O)NC(=O)C1CNCCN1
InChIInChI=1S/C7H14N4O2/c1-8-7(13)11-6(12)5-4-9-2-3-10-5/h5,9-10H,2-4H2,1H3,(H2,8,11,12,13)
InChIKeyQMNIJMCVEZTJTH-UHFFFAOYSA-N
MW186.21 g/mol
LogP-2.00
Rot. Bonds1

About N-(methylcarbamoyl)piperazine-2-carboxamide

N-(methylcarbamoyl)piperazine-2-carboxamide (PubChem CID 70071531) has the molecular formula C7H14N4O2 and a molecular weight of 186.21 g/mol. Its IUPAC name is N-(methylcarbamoyl)piperazine-2-carboxamide.

Molecular Properties

Compound NameN-(methylcarbamoyl)piperazine-2-carboxamide
PubChem CID70071531
Molecular FormulaC7H14N4O2
Molecular Weight186.21 g/mol
Exact Mass186.11
IUPAC NameN-(methylcarbamoyl)piperazine-2-carboxamide
SMILESCNC(=O)NC(=O)C1CNCCN1
InChIInChI=1S/C7H14N4O2/c1-8-7(13)11-6(12)5-4-9-2-3-10-5/h5,9-10H,2-4H2,1H3,(H2,8,11,12,13)
InChIKeyQMNIJMCVEZTJTH-UHFFFAOYSA-N
XLogP-2.00
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-2.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(methylcarbamoyl)piperazine-2-carboxamide?
The IUPAC name of N-(methylcarbamoyl)piperazine-2-carboxamide (CID 70071531) is N-(methylcarbamoyl)piperazine-2-carboxamide.
What is the SMILES notation for N-(methylcarbamoyl)piperazine-2-carboxamide?
The canonical SMILES for N-(methylcarbamoyl)piperazine-2-carboxamide is CNC(=O)NC(=O)C1CNCCN1.
What is the InChIKey of N-(methylcarbamoyl)piperazine-2-carboxamide?
The InChIKey is QMNIJMCVEZTJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O2/c1-8-7(13)11-6(12)5-4-9-2-3-10-5/h5,9-10H,2-4H2,1H3,(H2,8,11,12,13).
What are the key properties of N-(methylcarbamoyl)piperazine-2-carboxamide?
N-(methylcarbamoyl)piperazine-2-carboxamide has a molecular weight of 186.21 g/mol, XLogP of -2.00, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methylcarbamoyl)piperazine-2-carboxamide is sourced from PubChem (CID 70071531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).