N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide

C9H13N5O2 — CID 107437536

IUPACN-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide
SMILESCc1cn[nH]c1NC(=O)C1CNC(=O)CN1
InChIInChI=1S/C9H13N5O2/c1-5-2-12-14-8(5)13-9(16)6-3-11-7(15)4-10-6/h2,6,10H,3-4H2,1H3,(H,11,15)(H2,12,13,14,16)
InChIKeyCSHDZOHYHJCLQB-UHFFFAOYSA-N
MW223.24 g/mol
LogP-1.26
Rot. Bonds2

About N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide

N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide (PubChem CID 107437536) has the molecular formula C9H13N5O2 and a molecular weight of 223.24 g/mol. Its IUPAC name is N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide
PubChem CID107437536
Molecular FormulaC9H13N5O2
Molecular Weight223.24 g/mol
Exact Mass223.11
IUPAC NameN-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide
SMILESCc1cn[nH]c1NC(=O)C1CNC(=O)CN1
InChIInChI=1S/C9H13N5O2/c1-5-2-12-14-8(5)13-9(16)6-3-11-7(15)4-10-6/h2,6,10H,3-4H2,1H3,(H,11,15)(H2,12,13,14,16)
InChIKeyCSHDZOHYHJCLQB-UHFFFAOYSA-N
XLogP-1.26
TPSA98.91 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 5-1.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methyl-1H-pyrazol-3-yl)-5-oxopiperazine-2-carboxamide
CID 107436577
5-oxo-N-(thiadiazol-5-yl)piperazine-2-carboxamide
CID 107437804
N-(5-methyl-1,2-oxazol-3-yl)-5-oxopiperazine-2-carboxamide
CID 107433364
N-(3-acetamido-4-methylphenyl)-5-oxopiperazine-2-carboxamide
CID 107434723
N-(4-methyl-1H-pyrazol-5-yl)bicyclo[3.1.0]hexane-3-carboxamide
CID 104620156
5-oxo-N-(6-oxo-1H-pyridazin-3-yl)piperazine-2-carboxamide
CID 107437746
N-(5-cyano-2-methylphenyl)-5-oxopiperazine-2-carboxamide
CID 107436239
5-oxo-N-(1,3-thiazol-2-yl)piperazine-2-carboxamide
CID 107433315
N-(2-methoxy-4-methylphenyl)-5-oxopiperazine-2-carboxamide
CID 107434896
N-[4-methyl-3-(trifluoromethyl)phenyl]-5-oxopiperazine-2-carboxamide
CID 107436129
N-(4-hydroxyphenyl)-5-oxopiperazine-2-carboxamide
CID 107434569
N-(1-methylpyrazol-3-yl)-5-oxopiperazine-2-carboxamide
CID 107434741

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide?
The IUPAC name of N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide (CID 107437536) is N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide.
What is the SMILES notation for N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide?
The canonical SMILES for N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide is Cc1cn[nH]c1NC(=O)C1CNC(=O)CN1.
What is the InChIKey of N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide?
The InChIKey is CSHDZOHYHJCLQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5O2/c1-5-2-12-14-8(5)13-9(16)6-3-11-7(15)4-10-6/h2,6,10H,3-4H2,1H3,(H,11,15)(H2,12,13,14,16).
What are the key properties of N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide?
N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide has a molecular weight of 223.24 g/mol, XLogP of -1.26, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1H-pyrazol-5-yl)-5-oxopiperazine-2-carboxamide is sourced from PubChem (CID 107437536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).