N'-heptan-4-yl-N'-methyloctadecanehydrazide

C26H54N2O — CID 170523610

IUPACN'-heptan-4-yl-N'-methyloctadecanehydrazide
SMILESCCCCCCCCCCCCCCCCCC(=O)NN(C)C(CCC)CCC
InChIInChI=1S/C26H54N2O/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-26(29)27-28(4)25(22-6-2)23-7-3/h25H,5-24H2,1-4H3,(H,27,29)
InChIKeyMGIKSTBBXKUWOF-UHFFFAOYSA-N
MW410.73 g/mol
LogP8.18
Rot. Bonds22

About N'-heptan-4-yl-N'-methyloctadecanehydrazide

N'-heptan-4-yl-N'-methyloctadecanehydrazide (PubChem CID 170523610) has the molecular formula C26H54N2O and a molecular weight of 410.73 g/mol. Its IUPAC name is N'-heptan-4-yl-N'-methyloctadecanehydrazide.

Molecular Properties

Compound NameN'-heptan-4-yl-N'-methyloctadecanehydrazide
PubChem CID170523610
Molecular FormulaC26H54N2O
Molecular Weight410.73 g/mol
Exact Mass410.42
IUPAC NameN'-heptan-4-yl-N'-methyloctadecanehydrazide
SMILESCCCCCCCCCCCCCCCCCC(=O)NN(C)C(CCC)CCC
InChIInChI=1S/C26H54N2O/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-26(29)27-28(4)25(22-6-2)23-7-3/h25H,5-24H2,1-4H3,(H,27,29)
InChIKeyMGIKSTBBXKUWOF-UHFFFAOYSA-N
XLogP8.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds22
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.73
LogP ≤ 58.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N'-heptan-4-yl-N'-methyloctadecanehydrazide with MolForge

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

Launch Full Analysis

Related Compounds

N-pentan-2-ylundecanamide
CID 173258559
N',N'-diethylhexadecanehydrazide
CID 141450549
N-(1-hydroxybutyl)decanamide
CID 87762139
N'-(2-hydroxyethyl)-N'-methyldodecanehydrazide
CID 175333328
azane;N-[1-(dimethylamino)propyl]octadecanamide
CID 175326640
1-N',9-N'-di(heptanoyl)nonanedihydrazide
CID 154340616
N-decanoyldecanamide
CID 87914075
N-octadecan-2-ylhexadecanamide
CID 87600664
N-heptan-2-yldodecanamide
CID 3484810
N-[1-[hydroxy(propyl)amino]propyl]docosanamide
CID 175405068
N'-(2-hydroxyethyl)-N'-propylhexadecanehydrazide
CID 175534170
N-methylheptacosanamide
CID 18175889

Frequently Asked Questions

What is the IUPAC name of N'-heptan-4-yl-N'-methyloctadecanehydrazide?
The IUPAC name of N'-heptan-4-yl-N'-methyloctadecanehydrazide (CID 170523610) is N'-heptan-4-yl-N'-methyloctadecanehydrazide.
What is the SMILES notation for N'-heptan-4-yl-N'-methyloctadecanehydrazide?
The canonical SMILES for N'-heptan-4-yl-N'-methyloctadecanehydrazide is CCCCCCCCCCCCCCCCCC(=O)NN(C)C(CCC)CCC.
What is the InChIKey of N'-heptan-4-yl-N'-methyloctadecanehydrazide?
The InChIKey is MGIKSTBBXKUWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H54N2O/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-26(29)27-28(4)25(22-6-2)23-7-3/h25H,5-24H2,1-4H3,(H,27,29).
What are the key properties of N'-heptan-4-yl-N'-methyloctadecanehydrazide?
N'-heptan-4-yl-N'-methyloctadecanehydrazide has a molecular weight of 410.73 g/mol, XLogP of 8.18, 22 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-heptan-4-yl-N'-methyloctadecanehydrazide is sourced from PubChem (CID 170523610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).