4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one

C10H17N3O2 — CID 119326508

IUPAC4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one
SMILESC[C@@H](N)C(=O)N1CCN(C2CC2)C(=O)C1
InChIInChI=1S/C10H17N3O2/c1-7(11)10(15)12-4-5-13(8-2-3-8)9(14)6-12/h7-8H,2-6,11H2,1H3/t7-/m1/s1
InChIKeyNHJJZWKJFMENNF-SSDOTTSWSA-N
MW211.26 g/mol
LogP-0.83
Rot. Bonds2

About 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one

4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one (PubChem CID 119326508) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one.

Molecular Properties

Compound Name4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one
PubChem CID119326508
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one
SMILESC[C@@H](N)C(=O)N1CCN(C2CC2)C(=O)C1
InChIInChI=1S/C10H17N3O2/c1-7(11)10(15)12-4-5-13(8-2-3-8)9(14)6-12/h7-8H,2-6,11H2,1H3/t7-/m1/s1
InChIKeyNHJJZWKJFMENNF-SSDOTTSWSA-N
XLogP-0.83
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2S)-2-aminobutanoyl]-1-cyclopropylpiperazin-2-one;hydrochloride
CID 75495697
1-cyclopropyl-4-(2-phenylpropanoyl)piperazin-2-one
CID 119034196
4-[(2S)-2-cycloheptyloxypropanoyl]-1-cyclopropylpiperazin-2-one
CID 97321014
1-cyclopropyl-4-propanoylpiperazin-2-one
CID 110720711
4-cyclopropyl-N,N-diethyl-3-oxopiperazine-1-carboxamide
CID 110873293
4-[3-amino-2-(4-fluorophenyl)propanoyl]-1-cyclopropylpiperazin-2-one;hydrochloride
CID 120633509
7-(2-aminopropanoyl)-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 79091194
1-cyclopropyl-4-propan-2-ylpiperazin-2-one
CID 134166310
(2R)-2-amino-1-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)propan-1-one
CID 79170601
4-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-1-cyclohexylpiperazin-2-one
CID 118775809
1-[(2S)-2-aminopropanoyl]piperidin-3-one
CID 66564387
2-amino-1-(6-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)propan-1-one
CID 176568034

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one?
The IUPAC name of 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one (CID 119326508) is 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one.
What is the SMILES notation for 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one?
The canonical SMILES for 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one is C[C@@H](N)C(=O)N1CCN(C2CC2)C(=O)C1.
What is the InChIKey of 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one?
The InChIKey is NHJJZWKJFMENNF-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-7(11)10(15)12-4-5-13(8-2-3-8)9(14)6-12/h7-8H,2-6,11H2,1H3/t7-/m1/s1.
What are the key properties of 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one?
4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one has a molecular weight of 211.26 g/mol, XLogP of -0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-2-aminopropanoyl]-1-cyclopropylpiperazin-2-one is sourced from PubChem (CID 119326508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).