2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one

C11H21N3O — CID 105465242

IUPAC2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one
SMILESCC(N)CN1C(=O)CC(C)(C2CC2)N1C
InChIInChI=1S/C11H21N3O/c1-8(12)7-14-10(15)6-11(2,13(14)3)9-4-5-9/h8-9H,4-7,12H2,1-3H3
InChIKeyDPMBVXMGCQPRAZ-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.58
Rot. Bonds3

About 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one

2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one (PubChem CID 105465242) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one.

Molecular Properties

Compound Name2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one
PubChem CID105465242
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one
SMILESCC(N)CN1C(=O)CC(C)(C2CC2)N1C
InChIInChI=1S/C11H21N3O/c1-8(12)7-14-10(15)6-11(2,13(14)3)9-4-5-9/h8-9H,4-7,12H2,1-3H3
InChIKeyDPMBVXMGCQPRAZ-UHFFFAOYSA-N
XLogP0.58
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-aminopropyl)-1-cyclopentylpyrazolidin-3-one
CID 105465361
2-(2-aminopropyl)-5,5-dimethylpyrazolidin-3-one
CID 105434817
1-[(2R)-2-aminopropyl]-5,5-dimethylazepan-2-one
CID 103934843
5-(2-hydroxypropyl)-4-methyl-4,5-diazaspiro[2.4]heptan-6-one
CID 105441178
1-[(2S)-2-aminopropyl]pyrrolidine-2,5-dione
CID 30813187
3-(2-aminopropyl)-3-azaspiro[5.5]undecane-2,4-dione
CID 55228574
2-[(2R)-2-aminopropyl]-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
CID 104931620
1-(2-aminopropyl)-3-methyl-1,3-diazinan-2-one
CID 83816294
1-[(2S)-2-aminopropyl]piperidine-2,6-dione
CID 93050253
4-(2-aminopropyl)piperazine-2,6-dione
CID 102689066
1-[(2R)-2-aminopropyl]-5-ethylazepan-2-one
CID 103934825
2-(2,3-dimethyl-5-oxo-3-propan-2-ylpyrazolidin-1-yl)acetic acid
CID 105467609

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one?
The IUPAC name of 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one (CID 105465242) is 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one.
What is the SMILES notation for 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one?
The canonical SMILES for 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one is CC(N)CN1C(=O)CC(C)(C2CC2)N1C.
What is the InChIKey of 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one?
The InChIKey is DPMBVXMGCQPRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-8(12)7-14-10(15)6-11(2,13(14)3)9-4-5-9/h8-9H,4-7,12H2,1-3H3.
What are the key properties of 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one?
2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one has a molecular weight of 211.31 g/mol, XLogP of 0.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopropyl)-5-cyclopropyl-1,5-dimethylpyrazolidin-3-one is sourced from PubChem (CID 105465242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).