3,3-dimethylhexadecan-4-ylhydrazine

C18H40N2 — CID 105298722

IUPAC3,3-dimethylhexadecan-4-ylhydrazine
SMILESCCCCCCCCCCCCC(NN)C(C)(C)CC
InChIInChI=1S/C18H40N2/c1-5-7-8-9-10-11-12-13-14-15-16-17(20-19)18(3,4)6-2/h17,20H,5-16,19H2,1-4H3
InChIKeyJMWBAKBXTOXFQA-UHFFFAOYSA-N
MW284.53 g/mol
LogP5.57
Rot. Bonds14

About 3,3-dimethylhexadecan-4-ylhydrazine

3,3-dimethylhexadecan-4-ylhydrazine (PubChem CID 105298722) has the molecular formula C18H40N2 and a molecular weight of 284.53 g/mol. Its IUPAC name is 3,3-dimethylhexadecan-4-ylhydrazine.

Molecular Properties

Compound Name3,3-dimethylhexadecan-4-ylhydrazine
PubChem CID105298722
Molecular FormulaC18H40N2
Molecular Weight284.53 g/mol
Exact Mass284.32
IUPAC Name3,3-dimethylhexadecan-4-ylhydrazine
SMILESCCCCCCCCCCCCC(NN)C(C)(C)CC
InChIInChI=1S/C18H40N2/c1-5-7-8-9-10-11-12-13-14-15-16-17(20-19)18(3,4)6-2/h17,20H,5-16,19H2,1-4H3
InChIKeyJMWBAKBXTOXFQA-UHFFFAOYSA-N
XLogP5.57
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.53
LogP ≤ 55.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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

3,3-dimethylundecan-4-ylhydrazine
CID 105293669
2,2-dimethyltetradecan-3-ylhydrazine
CID 105305248
N,3,3-trimethylhexadecan-4-amine
CID 115846506
2,2-dimethyloctan-3-ylhydrazine
CID 105203149
(4R)-N,3,3-trimethylnonan-4-amine
CID 126620511
(3-ethyl-3-methoxytetradecan-4-yl)hydrazine
CID 105275563
3-ethyl-4-hydrazinyl-N,N-dimethylundecan-3-amine
CID 105241689
(3-ethoxy-3-methyldecan-4-yl)hydrazine
CID 105274844
(1-chloro-1,1-difluorooctan-2-yl)hydrazine
CID 105265550
3,3-dimethylnon-8-en-4-ylhydrazine
CID 105311424
(2-ethoxy-2-methyldodecan-3-yl)hydrazine
CID 105274061
2,5,5-trimethylheptan-4-ylhydrazine
CID 105282852

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethylhexadecan-4-ylhydrazine?
The IUPAC name of 3,3-dimethylhexadecan-4-ylhydrazine (CID 105298722) is 3,3-dimethylhexadecan-4-ylhydrazine.
What is the SMILES notation for 3,3-dimethylhexadecan-4-ylhydrazine?
The canonical SMILES for 3,3-dimethylhexadecan-4-ylhydrazine is CCCCCCCCCCCCC(NN)C(C)(C)CC.
What is the InChIKey of 3,3-dimethylhexadecan-4-ylhydrazine?
The InChIKey is JMWBAKBXTOXFQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40N2/c1-5-7-8-9-10-11-12-13-14-15-16-17(20-19)18(3,4)6-2/h17,20H,5-16,19H2,1-4H3.
What are the key properties of 3,3-dimethylhexadecan-4-ylhydrazine?
3,3-dimethylhexadecan-4-ylhydrazine has a molecular weight of 284.53 g/mol, XLogP of 5.57, 14 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethylhexadecan-4-ylhydrazine is sourced from PubChem (CID 105298722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).