4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide

C10H23N3O — CID 63583890

IUPAC4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide
SMILESCN(CCCC(=O)NN)CC(C)(C)C
InChIInChI=1S/C10H23N3O/c1-10(2,3)8-13(4)7-5-6-9(14)12-11/h5-8,11H2,1-4H3,(H,12,14)
InChIKeyNQMPZOXCYRIQOY-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.73
Rot. Bonds5

About 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide

4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide (PubChem CID 63583890) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide.

Molecular Properties

Compound Name4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide
PubChem CID63583890
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC Name4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide
SMILESCN(CCCC(=O)NN)CC(C)(C)C
InChIInChI=1S/C10H23N3O/c1-10(2,3)8-13(4)7-5-6-9(14)12-11/h5-8,11H2,1-4H3,(H,12,14)
InChIKeyNQMPZOXCYRIQOY-UHFFFAOYSA-N
XLogP0.73
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.73
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

4-[2,2-dimethylpropyl(methyl)amino]butanoic acid
CID 58066360
5-[butyl(methyl)amino]pentanehydrazide
CID 63570432
2-[(5-hydrazinyl-5-oxopentyl)-methylamino]-N,N-dimethylacetamide
CID 63572911
5-[3,3-dimethylbutan-2-yl(methyl)amino]pentanehydrazide
CID 63585409
hexanedihydrazide;pentanedihydrazide
CID 157195533
5-[methyl(2-pyrrolidin-1-ylethyl)amino]pentanehydrazide
CID 63573579
2-amino-4-[2,2-dimethylpropyl(methyl)amino]butanoic acid
CID 63053244
4-[ethyl(propan-2-yl)amino]butanehydrazide
CID 63573828
4-[cyclohexyl(methyl)amino]butanehydrazide
CID 63568701
4-[cycloheptyl(methyl)amino]butanehydrazide
CID 63571638
4-[2,2-dimethylpropyl(methyl)amino]-2-(ethylamino)butanamide
CID 63055540
N-(4-aminophenyl)-4-[(2-hydroxy-2-methylpropyl)-methylamino]butanamide
CID 79383773

Frequently Asked Questions

What is the IUPAC name of 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide?
The IUPAC name of 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide (CID 63583890) is 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide.
What is the SMILES notation for 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide?
The canonical SMILES for 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide is CN(CCCC(=O)NN)CC(C)(C)C.
What is the InChIKey of 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide?
The InChIKey is NQMPZOXCYRIQOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-10(2,3)8-13(4)7-5-6-9(14)12-11/h5-8,11H2,1-4H3,(H,12,14).
What are the key properties of 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide?
4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide has a molecular weight of 201.31 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,2-dimethylpropyl(methyl)amino]butanehydrazide is sourced from PubChem (CID 63583890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).