2-(dihexylamino)acetohydrazide

C14H31N3O — CID 17866

IUPAC2-(dihexylamino)acetohydrazide
SMILESCCCCCCN(CCCCCC)CC(=O)NN
InChIInChI=1S/C14H31N3O/c1-3-5-7-9-11-17(13-14(18)16-15)12-10-8-6-4-2/h3-13,15H2,1-2H3,(H,16,18)
InChIKeyOKYOQUKLWLYRCZ-UHFFFAOYSA-N
MW257.42 g/mol
LogP2.44
Rot. Bonds12

About 2-(dihexylamino)acetohydrazide

2-(dihexylamino)acetohydrazide (PubChem CID 17866) has the molecular formula C14H31N3O and a molecular weight of 257.42 g/mol. Its IUPAC name is 2-(dihexylamino)acetohydrazide.

Molecular Properties

Compound Name2-(dihexylamino)acetohydrazide
PubChem CID17866
Molecular FormulaC14H31N3O
Molecular Weight257.42 g/mol
Exact Mass257.25
IUPAC Name2-(dihexylamino)acetohydrazide
SMILESCCCCCCN(CCCCCC)CC(=O)NN
InChIInChI=1S/C14H31N3O/c1-3-5-7-9-11-17(13-14(18)16-15)12-10-8-6-4-2/h3-13,15H2,1-2H3,(H,16,18)
InChIKeyOKYOQUKLWLYRCZ-UHFFFAOYSA-N
XLogP2.44
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Glycine, N,N-dipropyl-, hydrazide
CID 17542
Glycine, N,N-diisopropyl-, hydrazide
CID 17543
Glycine, N,N-diisopentyl-, hydrazide
CID 17547
Glycine, N,N-dibutyl-, hydrazide
CID 17544
Glycine, N,N-diisobutyl-, hydrazide
CID 17545
Glycine, N,N-dipentyl-, hydrazide
CID 17546
N-Hexyl-2-hydrazineyl-2-oxoacetamide
CID 54005677
2-(Piperidin-1-yl)acetohydrazide
CID 6421769
Tetramethyllysine hydrazide
CID 129819779
N-(2-hydrazinyl-2-oxoethyl)-N,N-dimethylhexadecyl1-ammonium bromide
CID 171118143
2-(Azepan-1-yl)acetohydrazide
CID 4979896
2-(N-n-hexyl-N-methylamino)acetamide
CID 12878153

Frequently Asked Questions

What is the IUPAC name of 2-(dihexylamino)acetohydrazide?
The IUPAC name of 2-(dihexylamino)acetohydrazide (CID 17866) is 2-(dihexylamino)acetohydrazide.
What is the SMILES notation for 2-(dihexylamino)acetohydrazide?
The canonical SMILES for 2-(dihexylamino)acetohydrazide is CCCCCCN(CCCCCC)CC(=O)NN.
What is the InChIKey of 2-(dihexylamino)acetohydrazide?
The InChIKey is OKYOQUKLWLYRCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O/c1-3-5-7-9-11-17(13-14(18)16-15)12-10-8-6-4-2/h3-13,15H2,1-2H3,(H,16,18).
What are the key properties of 2-(dihexylamino)acetohydrazide?
2-(dihexylamino)acetohydrazide has a molecular weight of 257.42 g/mol, XLogP of 2.44, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dihexylamino)acetohydrazide is sourced from PubChem (CID 17866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).