1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one

C11H23N3O — CID 105467132

IUPAC1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one
SMILESCC(C)CN1C(=O)CCN1CC(C)(C)N
InChIInChI=1S/C11H23N3O/c1-9(2)7-14-10(15)5-6-13(14)8-11(3,4)12/h9H,5-8,12H2,1-4H3
InChIKeyZHSMWGPBEKVSLR-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.83
Rot. Bonds4

About 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one

1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one (PubChem CID 105467132) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one.

Molecular Properties

Compound Name1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one
PubChem CID105467132
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one
SMILESCC(C)CN1C(=O)CCN1CC(C)(C)N
InChIInChI=1S/C11H23N3O/c1-9(2)7-14-10(15)5-6-13(14)8-11(3,4)12/h9H,5-8,12H2,1-4H3
InChIKeyZHSMWGPBEKVSLR-UHFFFAOYSA-N
XLogP0.83
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-methylpropyl)-3-oxopyrazolidin-1-yl]acetic acid
CID 105452768
1-(2-amino-2-methylpropyl)-2-propan-2-yldiazinan-3-one
CID 105467128
2-[2-(2-methylpropyl)-3-oxodiazinan-1-yl]acetic acid
CID 105467640
1-(3-hydroxypropyl)-2-(2-methylpropyl)diazinan-3-one
CID 105467991
2-(2-amino-2-methylpropyl)-1-cyclopropylpyrazolidin-3-one
CID 105450992
2-(3-hydroxybutyl)-1-(2-methylpropyl)pyrazolidin-3-one
CID 105468014
1-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one
CID 105435195
2-(2-hydroxy-2-methylpropyl)-1-propylpyrazolidin-3-one
CID 105453030
3-(2-ethyl-3-oxopyrazolidin-1-yl)-2-methylpropanoic acid
CID 105452750
1-(2,4-dimethylpentan-2-yl)pyrrolidin-2-one
CID 130210872
4-(2-amino-2-methylpropyl)-1,2,4-triazolidine-3,5-dione
CID 107410051
2-(2-aminopropyl)-1-cyclopentylpyrazolidin-3-one
CID 105465361

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one?
The IUPAC name of 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one (CID 105467132) is 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one.
What is the SMILES notation for 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one?
The canonical SMILES for 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one is CC(C)CN1C(=O)CCN1CC(C)(C)N.
What is the InChIKey of 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one?
The InChIKey is ZHSMWGPBEKVSLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-9(2)7-14-10(15)5-6-13(14)8-11(3,4)12/h9H,5-8,12H2,1-4H3.
What are the key properties of 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one?
1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one has a molecular weight of 213.32 g/mol, XLogP of 0.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-methylpropyl)-2-(2-methylpropyl)pyrazolidin-3-one is sourced from PubChem (CID 105467132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).