4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide

C15H25N3O3 — CID 145076354

IUPAC4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide
SMILESCCCNNC(=O)C(C)(C)CC(C)(C)N1C(=O)C=CC1=O
InChIInChI=1S/C15H25N3O3/c1-6-9-16-17-13(21)14(2,3)10-15(4,5)18-11(19)7-8-12(18)20/h7-8,16H,6,9-10H2,1-5H3,(H,17,21)
InChIKeyMIXIZAXTOWCMFU-UHFFFAOYSA-N
MW295.38 g/mol
LogP1.14
Rot. Bonds7

About 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide

4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide (PubChem CID 145076354) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide.

Molecular Properties

Compound Name4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide
PubChem CID145076354
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide
SMILESCCCNNC(=O)C(C)(C)CC(C)(C)N1C(=O)C=CC1=O
InChIInChI=1S/C15H25N3O3/c1-6-9-16-17-13(21)14(2,3)10-15(4,5)18-11(19)7-8-12(18)20/h7-8,16H,6,9-10H2,1-5H3,(H,17,21)
InChIKeyMIXIZAXTOWCMFU-UHFFFAOYSA-N
XLogP1.14
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide?
The IUPAC name of 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide (CID 145076354) is 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide.
What is the SMILES notation for 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide?
The canonical SMILES for 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide is CCCNNC(=O)C(C)(C)CC(C)(C)N1C(=O)C=CC1=O.
What is the InChIKey of 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide?
The InChIKey is MIXIZAXTOWCMFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-6-9-16-17-13(21)14(2,3)10-15(4,5)18-11(19)7-8-12(18)20/h7-8,16H,6,9-10H2,1-5H3,(H,17,21).
What are the key properties of 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide?
4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide has a molecular weight of 295.38 g/mol, XLogP of 1.14, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dioxopyrrol-1-yl)-2,2,4-trimethyl-N'-propylpentanehydrazide is sourced from PubChem (CID 145076354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).