N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide

C10H21N3O2 — CID 144959673

IUPACN-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide
SMILESCN(CCC(=O)NN)C(=O)CC(C)(C)C
InChIInChI=1S/C10H21N3O2/c1-10(2,3)7-9(15)13(4)6-5-8(14)12-11/h5-7,11H2,1-4H3,(H,12,14)
InChIKeySAHMOCJHJWEVHQ-UHFFFAOYSA-N
MW215.30 g/mol
LogP0.26
Rot. Bonds4

About N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide

N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide (PubChem CID 144959673) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide.

Molecular Properties

Compound NameN-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide
PubChem CID144959673
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC NameN-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide
SMILESCN(CCC(=O)NN)C(=O)CC(C)(C)C
InChIInChI=1S/C10H21N3O2/c1-10(2,3)7-9(15)13(4)6-5-8(14)12-11/h5-7,11H2,1-4H3,(H,12,14)
InChIKeySAHMOCJHJWEVHQ-UHFFFAOYSA-N
XLogP0.26
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 50.26
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 N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide?
The IUPAC name of N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide (CID 144959673) is N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide.
What is the SMILES notation for N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide?
The canonical SMILES for N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide is CN(CCC(=O)NN)C(=O)CC(C)(C)C.
What is the InChIKey of N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide?
The InChIKey is SAHMOCJHJWEVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-10(2,3)7-9(15)13(4)6-5-8(14)12-11/h5-7,11H2,1-4H3,(H,12,14).
What are the key properties of N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide?
N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide has a molecular weight of 215.30 g/mol, XLogP of 0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydrazinyl-3-oxopropyl)-N,3,3-trimethylbutanamide is sourced from PubChem (CID 144959673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).