N-methyl-2-(4-methylphenyl)propanehydrazide

C11H16N2O — CID 116845714

IUPACN-methyl-2-(4-methylphenyl)propanehydrazide
SMILESCc1ccc(C(C)C(=O)N(C)N)cc1
InChIInChI=1S/C11H16N2O/c1-8-4-6-10(7-5-8)9(2)11(14)13(3)12/h4-7,9H,12H2,1-3H3
InChIKeyKRIVCPVSNBQRDQ-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.43
Rot. Bonds2

About N-methyl-2-(4-methylphenyl)propanehydrazide

N-methyl-2-(4-methylphenyl)propanehydrazide (PubChem CID 116845714) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-methyl-2-(4-methylphenyl)propanehydrazide.

Molecular Properties

Compound NameN-methyl-2-(4-methylphenyl)propanehydrazide
PubChem CID116845714
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-methyl-2-(4-methylphenyl)propanehydrazide
SMILESCc1ccc(C(C)C(=O)N(C)N)cc1
InChIInChI=1S/C11H16N2O/c1-8-4-6-10(7-5-8)9(2)11(14)13(3)12/h4-7,9H,12H2,1-3H3
InChIKeyKRIVCPVSNBQRDQ-UHFFFAOYSA-N
XLogP1.43
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

acetyl 2-(4-methylphenyl)propanoate
CID 174752977
2-(4-methylphenyl)propanoyl chloride
CID 14946079
(2R)-2-amino-N-methyl-N-[1-(4-methylphenyl)ethyl]propanamide
CID 78973314
2-(3-ethyl-4-methoxyphenyl)-N-methylpropanehydrazide
CID 116845766
sulfino 2-(4-methylphenyl)propanoate
CID 91617236
2-methylpropanoic acid;1,4-xylene
CID 142846820
2-[4-(1-carboxyethyl)phenyl]propanoic acid
CID 601009
N-methyl-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)propanehydrazide
CID 116845764
2-(4-methylphenyl)propanoyl sulfite
CID 91617235
4-amino-3-(4-methylphenyl)butan-2-one;N,N-dimethylmethanamine;dihydroiodide
CID 174439003
2-(4-methylphenyl)hexan-3-one
CID 83047098
(2S)-N-tert-butyl-2-(4-methylphenyl)-N-(2-methylsulfonylethyl)propanamide
CID 99856404

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-methylphenyl)propanehydrazide?
The IUPAC name of N-methyl-2-(4-methylphenyl)propanehydrazide (CID 116845714) is N-methyl-2-(4-methylphenyl)propanehydrazide.
What is the SMILES notation for N-methyl-2-(4-methylphenyl)propanehydrazide?
The canonical SMILES for N-methyl-2-(4-methylphenyl)propanehydrazide is Cc1ccc(C(C)C(=O)N(C)N)cc1.
What is the InChIKey of N-methyl-2-(4-methylphenyl)propanehydrazide?
The InChIKey is KRIVCPVSNBQRDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8-4-6-10(7-5-8)9(2)11(14)13(3)12/h4-7,9H,12H2,1-3H3.
What are the key properties of N-methyl-2-(4-methylphenyl)propanehydrazide?
N-methyl-2-(4-methylphenyl)propanehydrazide has a molecular weight of 192.26 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-methylphenyl)propanehydrazide is sourced from PubChem (CID 116845714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).