[1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine

C14H23ClN2 — CID 105331315

IUPAC[1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine
SMILESCc1ccc(C(CCCC(C)C)NN)cc1Cl
InChIInChI=1S/C14H23ClN2/c1-10(2)5-4-6-14(17-16)12-8-7-11(3)13(15)9-12/h7-10,14,17H,4-6,16H2,1-3H3
InChIKeyZASZGWFFUSAGOM-UHFFFAOYSA-N
MW254.81 g/mol
LogP3.98
Rot. Bonds6

About [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine

[1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine (PubChem CID 105331315) has the molecular formula C14H23ClN2 and a molecular weight of 254.81 g/mol. Its IUPAC name is [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine
PubChem CID105331315
Molecular FormulaC14H23ClN2
Molecular Weight254.81 g/mol
Exact Mass254.15
IUPAC Name[1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine
SMILESCc1ccc(C(CCCC(C)C)NN)cc1Cl
InChIInChI=1S/C14H23ClN2/c1-10(2)5-4-6-14(17-16)12-8-7-11(3)13(15)9-12/h7-10,14,17H,4-6,16H2,1-3H3
InChIKeyZASZGWFFUSAGOM-UHFFFAOYSA-N
XLogP3.98
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.81
LogP ≤ 53.98
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

1-(3-chloro-4-methylphenyl)-5-methylhexan-1-amine
CID 105028693
[1-(3-chloro-4-methylphenyl)-4,4,4-trifluorobutyl]hydrazine
CID 105313900
1-(3-chloro-4-methylphenyl)-N,4-dimethylpentan-1-amine
CID 115834684
[1-(3-chloro-4-methylphenyl)-3-cyclopropylpropyl]hydrazine
CID 105315126
[1-(3-chloro-4-methylphenyl)-3-ethylpentyl]hydrazine
CID 105331071
[1-(3-chloro-4-iodophenyl)-4-methylpentyl]hydrazine
CID 103217356
[1-(3-chloro-4-methylphenyl)-3-thiophen-2-ylpropyl]hydrazine
CID 105308904
[1-(3-chloro-4-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]hydrazine
CID 107562550
[1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine
CID 105310083
[2-tert-butylsulfanyl-1-(3-chloro-4-methylphenyl)ethyl]hydrazine
CID 107562353
[1-(3-chloro-4-methylphenyl)-2-(4-iodophenyl)ethyl]hydrazine
CID 105310314
[1-(3-chloro-4-methylphenyl)-3-(1-methylimidazol-2-yl)propyl]hydrazine
CID 105340350

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine?
The IUPAC name of [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine (CID 105331315) is [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine?
The canonical SMILES for [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine is Cc1ccc(C(CCCC(C)C)NN)cc1Cl.
What is the InChIKey of [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine?
The InChIKey is ZASZGWFFUSAGOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23ClN2/c1-10(2)5-4-6-14(17-16)12-8-7-11(3)13(15)9-12/h7-10,14,17H,4-6,16H2,1-3H3.
What are the key properties of [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine?
[1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine has a molecular weight of 254.81 g/mol, XLogP of 3.98, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-4-methylphenyl)-5-methylhexyl]hydrazine is sourced from PubChem (CID 105331315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).