2-butan-2-ylpropanedihydrazide

C7H16N4O2 — CID 15253260

IUPAC2-butan-2-ylpropanedihydrazide
SMILESCCC(C)C(C(=O)NN)C(=O)NN
InChIInChI=1S/C7H16N4O2/c1-3-4(2)5(6(12)10-8)7(13)11-9/h4-5H,3,8-9H2,1-2H3,(H,10,12)(H,11,13)
InChIKeyDAQWRHVEGFQRBO-UHFFFAOYSA-N
MW188.23 g/mol
LogP-1.37
Rot. Bonds4

About 2-butan-2-ylpropanedihydrazide

2-butan-2-ylpropanedihydrazide (PubChem CID 15253260) has the molecular formula C7H16N4O2 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-butan-2-ylpropanedihydrazide.

Molecular Properties

Compound Name2-butan-2-ylpropanedihydrazide
PubChem CID15253260
Molecular FormulaC7H16N4O2
Molecular Weight188.23 g/mol
Exact Mass188.13
IUPAC Name2-butan-2-ylpropanedihydrazide
SMILESCCC(C)C(C(=O)NN)C(=O)NN
InChIInChI=1S/C7H16N4O2/c1-3-4(2)5(6(12)10-8)7(13)11-9/h4-5H,3,8-9H2,1-2H3,(H,10,12)(H,11,13)
InChIKeyDAQWRHVEGFQRBO-UHFFFAOYSA-N
XLogP-1.37
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 5-1.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-aminooxybutanehydrazide
CID 19105384
2-[(2R)-butan-2-yl]propanedioic acid
CID 51381327
2-sulfanylbutanehydrazide
CID 63590292
ethyl 2-methylpropanoate;2-methylpropanehydrazide
CID 159155209
(2R,3R)-2-amino-N-[(2S)-butan-2-yl]-3-methylpentanamide
CID 93001596
2-methylpentanehydrazide
CID 43183484
2-(hydrazinecarbonyl)butanamide
CID 119096402
tert-butyl N-(1-hydrazinyl-3-methyl-1-oxopentan-2-yl)carbamate
CID 50945788
2-(2-methoxyethoxy)butanehydrazide
CID 63575929
(2S,3R)-2-amino-N-hydroxy-3-methylpentanamide
CID 129369774
N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide
CID 10464584
2-ethoxycarbonyl-3-methylpentanoic acid
CID 53414267

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-ylpropanedihydrazide?
The IUPAC name of 2-butan-2-ylpropanedihydrazide (CID 15253260) is 2-butan-2-ylpropanedihydrazide.
What is the SMILES notation for 2-butan-2-ylpropanedihydrazide?
The canonical SMILES for 2-butan-2-ylpropanedihydrazide is CCC(C)C(C(=O)NN)C(=O)NN.
What is the InChIKey of 2-butan-2-ylpropanedihydrazide?
The InChIKey is DAQWRHVEGFQRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N4O2/c1-3-4(2)5(6(12)10-8)7(13)11-9/h4-5H,3,8-9H2,1-2H3,(H,10,12)(H,11,13).
What are the key properties of 2-butan-2-ylpropanedihydrazide?
2-butan-2-ylpropanedihydrazide has a molecular weight of 188.23 g/mol, XLogP of -1.37, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-ylpropanedihydrazide is sourced from PubChem (CID 15253260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).