3-methyl-N'-(4-methylhexanoyl)hexanehydrazide

C14H28N2O2 — CID 19069832

IUPAC3-methyl-N'-(4-methylhexanoyl)hexanehydrazide
SMILESCCCC(C)CC(=O)NNC(=O)CCC(C)CC
InChIInChI=1S/C14H28N2O2/c1-5-7-12(4)10-14(18)16-15-13(17)9-8-11(3)6-2/h11-12H,5-10H2,1-4H3,(H,15,17)(H,16,18)
InChIKeyYVHNUFCLFWVONG-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.79
Rot. Bonds8

About 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide

3-methyl-N'-(4-methylhexanoyl)hexanehydrazide (PubChem CID 19069832) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide.

Molecular Properties

Compound Name3-methyl-N'-(4-methylhexanoyl)hexanehydrazide
PubChem CID19069832
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name3-methyl-N'-(4-methylhexanoyl)hexanehydrazide
SMILESCCCC(C)CC(=O)NNC(=O)CCC(C)CC
InChIInChI=1S/C14H28N2O2/c1-5-7-12(4)10-14(18)16-15-13(17)9-8-11(3)6-2/h11-12H,5-10H2,1-4H3,(H,15,17)(H,16,18)
InChIKeyYVHNUFCLFWVONG-UHFFFAOYSA-N
XLogP2.79
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide?
The IUPAC name of 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide (CID 19069832) is 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide.
What is the SMILES notation for 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide?
The canonical SMILES for 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide is CCCC(C)CC(=O)NNC(=O)CCC(C)CC.
What is the InChIKey of 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide?
The InChIKey is YVHNUFCLFWVONG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-5-7-12(4)10-14(18)16-15-13(17)9-8-11(3)6-2/h11-12H,5-10H2,1-4H3,(H,15,17)(H,16,18).
What are the key properties of 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide?
3-methyl-N'-(4-methylhexanoyl)hexanehydrazide has a molecular weight of 256.39 g/mol, XLogP of 2.79, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N'-(4-methylhexanoyl)hexanehydrazide is sourced from PubChem (CID 19069832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).