4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one

C11H19N3O3 — CID 60510014

IUPAC4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one
SMILESO=C1CN(C(=O)CN(CCO)C2CC2)CCN1
InChIInChI=1S/C11H19N3O3/c15-6-5-13(9-1-2-9)8-11(17)14-4-3-12-10(16)7-14/h9,15H,1-8H2,(H,12,16)
InChIKeyRCMBRIPFULZSPI-UHFFFAOYSA-N
MW241.29 g/mol
LogP-1.60
Rot. Bonds5

About 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one

4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one (PubChem CID 60510014) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one.

Molecular Properties

Compound Name4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one
PubChem CID60510014
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one
SMILESO=C1CN(C(=O)CN(CCO)C2CC2)CCN1
InChIInChI=1S/C11H19N3O3/c15-6-5-13(9-1-2-9)8-11(17)14-4-3-12-10(16)7-14/h9,15H,1-8H2,(H,12,16)
InChIKeyRCMBRIPFULZSPI-UHFFFAOYSA-N
XLogP-1.60
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-1.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-[benzyl(cyclohexyl)amino]acetyl]piperazin-2-one
CID 71891023
2-[cyclopropyl(2-hydroxyethyl)amino]-1-morpholin-4-ylethanone
CID 60774443
4-[2-(4-methylpiperidin-1-yl)acetyl]piperazin-2-one
CID 36800649
N,N-dimethyl-2-[methyl-[2-oxo-2-(3-oxopiperazin-1-yl)ethyl]amino]acetamide
CID 30758749
4-[2-[cyclopropyl(2,3-dihydro-1H-inden-1-yl)amino]acetyl]piperazin-2-one
CID 56821521
4-[2-(azetidin-3-yloxy)acetyl]piperazin-2-one
CID 119681648
1-[2-[cyclobutyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one
CID 102870091
3-oxo-3-(3-oxopiperazin-1-yl)propanenitrile
CID 24700108
4-(2-pyrrolidin-2-ylacetyl)piperazin-2-one;hydrochloride
CID 119681672
6-oxo-6-(3-oxopiperazin-1-yl)hexanoic acid
CID 43447158
1-[2-[cyclohexyl(2-hydroxyethyl)amino]acetyl]pyrrolidin-2-one
CID 60694146
4-[2-(1,1-dioxothiolan-3-yl)acetyl]piperazin-2-one
CID 55023787

Frequently Asked Questions

What is the IUPAC name of 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one?
The IUPAC name of 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one (CID 60510014) is 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one.
What is the SMILES notation for 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one?
The canonical SMILES for 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one is O=C1CN(C(=O)CN(CCO)C2CC2)CCN1.
What is the InChIKey of 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one?
The InChIKey is RCMBRIPFULZSPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c15-6-5-13(9-1-2-9)8-11(17)14-4-3-12-10(16)7-14/h9,15H,1-8H2,(H,12,16).
What are the key properties of 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one?
4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one has a molecular weight of 241.29 g/mol, XLogP of -1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[cyclopropyl(2-hydroxyethyl)amino]acetyl]piperazin-2-one is sourced from PubChem (CID 60510014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).