4-(2-aminopentanoyl)-1-methylpiperazin-2-one

C10H19N3O2 — CID 64681612

IUPAC4-(2-aminopentanoyl)-1-methylpiperazin-2-one
SMILESCCCC(N)C(=O)N1CCN(C)C(=O)C1
InChIInChI=1S/C10H19N3O2/c1-3-4-8(11)10(15)13-6-5-12(2)9(14)7-13/h8H,3-7,11H2,1-2H3
InChIKeySCPLSZWMLAZZEC-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.59
Rot. Bonds3

About 4-(2-aminopentanoyl)-1-methylpiperazin-2-one

4-(2-aminopentanoyl)-1-methylpiperazin-2-one (PubChem CID 64681612) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 4-(2-aminopentanoyl)-1-methylpiperazin-2-one.

Molecular Properties

Compound Name4-(2-aminopentanoyl)-1-methylpiperazin-2-one
PubChem CID64681612
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name4-(2-aminopentanoyl)-1-methylpiperazin-2-one
SMILESCCCC(N)C(=O)N1CCN(C)C(=O)C1
InChIInChI=1S/C10H19N3O2/c1-3-4-8(11)10(15)13-6-5-12(2)9(14)7-13/h8H,3-7,11H2,1-2H3
InChIKeySCPLSZWMLAZZEC-UHFFFAOYSA-N
XLogP-0.59
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-amino-3-methoxypropanoyl)-1-methylpiperazin-2-one
CID 81102582
2-(4-methyl-3-oxopiperazine-1-carbonyl)pentanenitrile
CID 64683059
4-(2-amino-4-methylsulfonylbutanoyl)-1-methyl-1,4-diazepan-2-one
CID 102888795
4-(2-bromobutanoyl)-1-methylpiperazin-2-one
CID 64681143
1-methyl-4-propanoylpiperazin-2-one
CID 64693548
4-[(2S)-2-aminopentanoyl]piperazine-2,6-dione
CID 107569988
4-(2-amino-4-phenylbutanoyl)-1-methyl-1,4-diazepan-2-one
CID 102888793
4-butanoyl-1-methylpiperazin-2-one
CID 64693337
2-methyl-3-(4-methyl-3-oxopiperazin-1-yl)-3-oxopropanethioamide
CID 64680974
(2R)-2-amino-1-[4-(3-methylbutyl)piperazin-1-yl]pentan-1-one
CID 93375585
2-amino-1-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-1-one
CID 43650100
2-amino-1-(azocan-1-yl)pentan-1-one;hydrochloride
CID 119264220

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopentanoyl)-1-methylpiperazin-2-one?
The IUPAC name of 4-(2-aminopentanoyl)-1-methylpiperazin-2-one (CID 64681612) is 4-(2-aminopentanoyl)-1-methylpiperazin-2-one.
What is the SMILES notation for 4-(2-aminopentanoyl)-1-methylpiperazin-2-one?
The canonical SMILES for 4-(2-aminopentanoyl)-1-methylpiperazin-2-one is CCCC(N)C(=O)N1CCN(C)C(=O)C1.
What is the InChIKey of 4-(2-aminopentanoyl)-1-methylpiperazin-2-one?
The InChIKey is SCPLSZWMLAZZEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-3-4-8(11)10(15)13-6-5-12(2)9(14)7-13/h8H,3-7,11H2,1-2H3.
What are the key properties of 4-(2-aminopentanoyl)-1-methylpiperazin-2-one?
4-(2-aminopentanoyl)-1-methylpiperazin-2-one has a molecular weight of 213.28 g/mol, XLogP of -0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopentanoyl)-1-methylpiperazin-2-one is sourced from PubChem (CID 64681612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).