[1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine

C15H26N2 — CID 105287241

IUPAC[1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine
SMILESCCCC(C)C(Cc1cc(C)cc(C)c1)NN
InChIInChI=1S/C15H26N2/c1-5-6-13(4)15(17-16)10-14-8-11(2)7-12(3)9-14/h7-9,13,15,17H,5-6,10,16H2,1-4H3
InChIKeyGKEHBSOPXZMVCO-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.11
Rot. Bonds6

About [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine

[1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine (PubChem CID 105287241) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine
PubChem CID105287241
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name[1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine
SMILESCCCC(C)C(Cc1cc(C)cc(C)c1)NN
InChIInChI=1S/C15H26N2/c1-5-6-13(4)15(17-16)10-14-8-11(2)7-12(3)9-14/h7-9,13,15,17H,5-6,10,16H2,1-4H3
InChIKeyGKEHBSOPXZMVCO-UHFFFAOYSA-N
XLogP3.11
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Phenelzine
CID 3675
Pheniprazine
CID 5929
Mebanazine
CID 6179
Ljp-1207
CID 11679937
2-(3-Methylphenyl)ethan-1-amine
CID 410085
Phenelzine hydrochloride
CID 154983
Pheniprazine Hydrochloride
CID 6182
(2-Phenylpropyl)hydrazine
CID 6183
Phenelzine Dihydrochloride
CID 28134
alpha,beta-Dimethylbenzeneethanamine
CID 210912
Phenethylamine, alpha-propyl-
CID 115410
1-Methyl-2-(3-phenylpropyl)hydrazine dihydrochloride salt (9d)
CID 27953

Frequently Asked Questions

What is the IUPAC name of [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine?
The IUPAC name of [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine (CID 105287241) is [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine.
What is the SMILES notation for [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine?
The canonical SMILES for [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine is CCCC(C)C(Cc1cc(C)cc(C)c1)NN.
What is the InChIKey of [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine?
The InChIKey is GKEHBSOPXZMVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-5-6-13(4)15(17-16)10-14-8-11(2)7-12(3)9-14/h7-9,13,15,17H,5-6,10,16H2,1-4H3.
What are the key properties of [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine?
[1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine has a molecular weight of 234.39 g/mol, XLogP of 3.11, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine is sourced from PubChem (CID 105287241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).