3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide

C10H21N3O — CID 63585215

IUPAC3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide
SMILESCC(CC(=O)NN)N1CCCC1(C)C
InChIInChI=1S/C10H21N3O/c1-8(7-9(14)12-11)13-6-4-5-10(13,2)3/h8H,4-7,11H2,1-3H3,(H,12,14)
InChIKeyWEKRZXUNDLNZKJ-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.63
Rot. Bonds3

About 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide

3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide (PubChem CID 63585215) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide.

Molecular Properties

Compound Name3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide
PubChem CID63585215
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide
SMILESCC(CC(=O)NN)N1CCCC1(C)C
InChIInChI=1S/C10H21N3O/c1-8(7-9(14)12-11)13-6-4-5-10(13,2)3/h8H,4-7,11H2,1-3H3,(H,12,14)
InChIKeyWEKRZXUNDLNZKJ-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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Related Compounds

ethyl 3-(2,2-dimethylpyrrolidin-1-yl)butanoate
CID 63219741
3-(2,2-dimethylpyrrolidin-1-yl)-2-methylbutanehydrazide
CID 79409006
3-thiomorpholin-4-ylbutanehydrazide
CID 63569224
methyl 2-amino-4-(2,2-dimethylpyrrolidin-1-yl)-2-methylpentanoate
CID 64702799
3-(4-butan-2-ylpiperazin-1-yl)butanehydrazide
CID 63573949
3-(2-methylpyrrolidin-1-yl)butanehydrazide
CID 63569163
4-amino-N-tert-butyl-3-(2,2-dimethylpyrrolidin-1-yl)butanamide
CID 66431643
3-pyrrol-1-ylbutanehydrazide;hydrochloride
CID 130629139
3-[4-(2-methylpropyl)piperazin-1-yl]butanehydrazide
CID 63572637
2-amino-3-(2,2-dimethylpyrrolidin-1-yl)butanoic acid
CID 164657593
3-amino-2-(2,2-dimethylpyrrolidin-1-yl)propanoic acid
CID 64695632
3-(2-ethylpiperidin-1-yl)butanehydrazide
CID 63573262

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide?
The IUPAC name of 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide (CID 63585215) is 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide.
What is the SMILES notation for 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide?
The canonical SMILES for 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide is CC(CC(=O)NN)N1CCCC1(C)C.
What is the InChIKey of 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide?
The InChIKey is WEKRZXUNDLNZKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8(7-9(14)12-11)13-6-4-5-10(13,2)3/h8H,4-7,11H2,1-3H3,(H,12,14).
What are the key properties of 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide?
3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide 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 3-(2,2-dimethylpyrrolidin-1-yl)butanehydrazide is sourced from PubChem (CID 63585215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).