2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide

C14H22N2O — CID 116848187

IUPAC2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide
SMILESCc1ccc(C(C)(C)C(=O)NN(C)C)cc1C
InChIInChI=1S/C14H22N2O/c1-10-7-8-12(9-11(10)2)14(3,4)13(17)15-16(5)6/h7-9H,1-6H3,(H,15,17)
InChIKeyLUHHPBSSIOZXIR-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.17
Rot. Bonds3

About 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide

2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide (PubChem CID 116848187) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide.

Molecular Properties

Compound Name2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide
PubChem CID116848187
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide
SMILESCc1ccc(C(C)(C)C(=O)NN(C)C)cc1C
InChIInChI=1S/C14H22N2O/c1-10-7-8-12(9-11(10)2)14(3,4)13(17)15-16(5)6/h7-9H,1-6H3,(H,15,17)
InChIKeyLUHHPBSSIOZXIR-UHFFFAOYSA-N
XLogP2.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxy-N',N'-dimethyl-2,2-diphenylacetohydrazide
CID 12885881
3-[2-(3,4-dimethylphenyl)propan-2-yl-methylamino]-3-methylbutan-2-one
CID 143822904
2-(5-fluoro-2-methoxyphenyl)-N',N',2-trimethylpropanehydrazide
CID 116848201
2-(4-fluoro-3-methylphenyl)-2-methylpropanehydrazide
CID 116843969
lithium (Z)-5-(3,4-dimethylphenyl)-2,2,4,5-tetramethylhex-3-en-3-olate
CID 101163087
2-amino-2-(3,4-dimethylphenyl)propanoic acid
CID 24711823
2-acetamido-2-(3,4-dimethylphenyl)propanoic acid
CID 63705027
methyl 2-(4-methoxy-3-methylphenyl)-2-methylpropanoate
CID 116963053
2-(4-tert-butyl-2-methylphenyl)-N,2-dimethylpropanehydrazide
CID 116845949
N,N'-bis(3,4-dimethylphenyl)-2,2-dimethylpropanediamide
CID 108967928
5-tert-butyl-2-methoxy-N',N'-dimethylbenzohydrazide
CID 116847946
N-[4-(dimethylamino)phenyl]-2-methyl-2-(4-methylphenyl)propanamide
CID 113198132

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide?
The IUPAC name of 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide (CID 116848187) is 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide.
What is the SMILES notation for 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide?
The canonical SMILES for 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide is Cc1ccc(C(C)(C)C(=O)NN(C)C)cc1C.
What is the InChIKey of 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide?
The InChIKey is LUHHPBSSIOZXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-10-7-8-12(9-11(10)2)14(3,4)13(17)15-16(5)6/h7-9H,1-6H3,(H,15,17).
What are the key properties of 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide?
2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide has a molecular weight of 234.34 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenyl)-N',N',2-trimethylpropanehydrazide is sourced from PubChem (CID 116848187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).