2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide

C10H21N3O — CID 83223630

IUPAC2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide
SMILESCCC1CCC(C)N1C(C)C(=O)NN
InChIInChI=1S/C10H21N3O/c1-4-9-6-5-7(2)13(9)8(3)10(14)12-11/h7-9H,4-6,11H2,1-3H3,(H,12,14)
InChIKeyXRKFYPCKGKEWGE-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.63
Rot. Bonds3

About 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide

2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide (PubChem CID 83223630) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide.

Molecular Properties

Compound Name2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide
PubChem CID83223630
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide
SMILESCCC1CCC(C)N1C(C)C(=O)NN
InChIInChI=1S/C10H21N3O/c1-4-9-6-5-7(2)13(9)8(3)10(14)12-11/h7-9H,4-6,11H2,1-3H3,(H,12,14)
InChIKeyXRKFYPCKGKEWGE-UHFFFAOYSA-N
XLogP0.63
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide?
The IUPAC name of 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide (CID 83223630) is 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide.
What is the SMILES notation for 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide?
The canonical SMILES for 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide is CCC1CCC(C)N1C(C)C(=O)NN.
What is the InChIKey of 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide?
The InChIKey is XRKFYPCKGKEWGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-4-9-6-5-7(2)13(9)8(3)10(14)12-11/h7-9H,4-6,11H2,1-3H3,(H,12,14).
What are the key properties of 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide?
2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide has a molecular weight of 199.30 g/mol, XLogP of 0.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-5-methylpyrrolidin-1-yl)propanehydrazide is sourced from PubChem (CID 83223630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).