5-oxo-N-pentan-3-ylpiperazine-2-carboxamide

C10H19N3O2 — CID 107433338

IUPAC5-oxo-N-pentan-3-ylpiperazine-2-carboxamide
SMILESCCC(CC)NC(=O)C1CNC(=O)CN1
InChIInChI=1S/C10H19N3O2/c1-3-7(4-2)13-10(15)8-5-12-9(14)6-11-8/h7-8,11H,3-6H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyMFQLMZQZKSASNT-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.62
Rot. Bonds4

About 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide

5-oxo-N-pentan-3-ylpiperazine-2-carboxamide (PubChem CID 107433338) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide.

Molecular Properties

Compound Name5-oxo-N-pentan-3-ylpiperazine-2-carboxamide
PubChem CID107433338
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name5-oxo-N-pentan-3-ylpiperazine-2-carboxamide
SMILESCCC(CC)NC(=O)C1CNC(=O)CN1
InChIInChI=1S/C10H19N3O2/c1-3-7(4-2)13-10(15)8-5-12-9(14)6-11-8/h7-8,11H,3-6H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyMFQLMZQZKSASNT-UHFFFAOYSA-N
XLogP-0.62
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[(5-oxopiperazine-2-carbonyl)amino]pentanoic acid
CID 107565066
N-(1-methoxypropan-2-yl)-5-oxopiperazine-2-carboxamide
CID 107433403
N-[1-(2-methoxyphenyl)propyl]-5-oxopiperazine-2-carboxamide
CID 107434346
methyl 2-[(5-oxopiperazine-2-carbonyl)amino]propanoate
CID 107436041
5-[(5-oxopiperazine-2-carbonyl)amino]hexanoic acid
CID 107437399
N-[(2R)-2-hydroxypropyl]-5-oxopiperazine-2-carboxamide
CID 107437971
N-[1-(cyclopropylamino)-1-oxopropan-2-yl]-5-oxopiperazine-2-carboxamide
CID 107437497
5-methyl-N-pentan-3-ylpiperazine-2-carboxamide
CID 63102564
5-oxo-N-[1-(1H-pyrazol-4-yl)ethyl]piperazine-2-carboxamide
CID 114158960
N-[1-(oxan-4-yl)ethyl]-5-oxopiperazine-2-carboxamide
CID 114115158
N-[1-(4-fluorophenyl)ethyl]-5-oxopiperazine-2-carboxamide
CID 107435694
N-ethyl-N-methyl-5-oxopiperazine-2-carboxamide
CID 107433774

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide?
The IUPAC name of 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide (CID 107433338) is 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide.
What is the SMILES notation for 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide?
The canonical SMILES for 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide is CCC(CC)NC(=O)C1CNC(=O)CN1.
What is the InChIKey of 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide?
The InChIKey is MFQLMZQZKSASNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-3-7(4-2)13-10(15)8-5-12-9(14)6-11-8/h7-8,11H,3-6H2,1-2H3,(H,12,14)(H,13,15).
What are the key properties of 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide?
5-oxo-N-pentan-3-ylpiperazine-2-carboxamide has a molecular weight of 213.28 g/mol, XLogP of -0.62, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-pentan-3-ylpiperazine-2-carboxamide is sourced from PubChem (CID 107433338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).