1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine

C11H17ClN2 — CID 106868414

IUPAC1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine
SMILESCCC(Cc1ccc(C)cc1Cl)NN
InChIInChI=1S/C11H17ClN2/c1-3-10(14-13)7-9-5-4-8(2)6-11(9)12/h4-6,10,14H,3,7,13H2,1-2H3
InChIKeyUITVMCKOQXBFCP-UHFFFAOYSA-N
MW212.72 g/mol
LogP2.43
Rot. Bonds4

About 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine

1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine (PubChem CID 106868414) has the molecular formula C11H17ClN2 and a molecular weight of 212.72 g/mol. Its IUPAC name is 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine.

Molecular Properties

Compound Name1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine
PubChem CID106868414
Molecular FormulaC11H17ClN2
Molecular Weight212.72 g/mol
Exact Mass212.11
IUPAC Name1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine
SMILESCCC(Cc1ccc(C)cc1Cl)NN
InChIInChI=1S/C11H17ClN2/c1-3-10(14-13)7-9-5-4-8(2)6-11(9)12/h4-6,10,14H,3,7,13H2,1-2H3
InChIKeyUITVMCKOQXBFCP-UHFFFAOYSA-N
XLogP2.43
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.72
LogP ≤ 52.43
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

4-(2-chloro-4-methylphenyl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 106871466
[1-(2-chloro-4-methylphenyl)-4-methoxybutan-2-yl]hydrazine
CID 106868463
[1-(2-chloro-4-methylphenyl)-4,5,5-trimethylhexan-2-yl]hydrazine
CID 106868573
[1-(4-bromo-2-chlorophenyl)-3-(2,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105335288
[1-(2-chloro-4-methylphenyl)-3-thiophen-2-ylpropan-2-yl]hydrazine
CID 106868502
[1-(2-chloro-4-methylphenyl)-3-pyridin-3-ylpropan-2-yl]hydrazine
CID 106868440
[1-(2-chloro-4-methylphenyl)-4-pyridin-4-ylbutan-2-yl]hydrazine
CID 106868466
1-(2-chloro-4-methylphenyl)-N-ethyl-3-(4-methylphenyl)propan-2-amine
CID 106867468
1-(2-chloro-4-methylphenyl)-N,4-dimethylpentan-2-amine
CID 106865986
1-bromo-N-[(2-chloro-4-methylphenyl)methyl]pentan-3-amine
CID 106869904
2-[(2-chloro-4-methylphenyl)methyl]butan-1-ol
CID 106870597
1-(2-chloro-4-methylphenyl)-N,5-dimethylhexan-2-amine
CID 106866712

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine?
The IUPAC name of 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine (CID 106868414) is 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine.
What is the SMILES notation for 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine?
The canonical SMILES for 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine is CCC(Cc1ccc(C)cc1Cl)NN.
What is the InChIKey of 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine?
The InChIKey is UITVMCKOQXBFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2/c1-3-10(14-13)7-9-5-4-8(2)6-11(9)12/h4-6,10,14H,3,7,13H2,1-2H3.
What are the key properties of 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine?
1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine has a molecular weight of 212.72 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4-methylphenyl)butan-2-ylhydrazine is sourced from PubChem (CID 106868414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).