1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide

C15H22N2O — CID 11955881

IUPAC1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide
SMILESCc1ccccc1NNC(=O)C1(C)CCCCC1
InChIInChI=1S/C15H22N2O/c1-12-8-4-5-9-13(12)16-17-14(18)15(2)10-6-3-7-11-15/h4-5,8-9,16H,3,6-7,10-11H2,1-2H3,(H,17,18)
InChIKeyJWCPNGHLMPZESN-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.41
Rot. Bonds3

About 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide

1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide (PubChem CID 11955881) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide.

Molecular Properties

Compound Name1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide
PubChem CID11955881
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide
SMILESCc1ccccc1NNC(=O)C1(C)CCCCC1
InChIInChI=1S/C15H22N2O/c1-12-8-4-5-9-13(12)16-17-14(18)15(2)10-6-3-7-11-15/h4-5,8-9,16H,3,6-7,10-11H2,1-2H3,(H,17,18)
InChIKeyJWCPNGHLMPZESN-UHFFFAOYSA-N
XLogP3.41
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide?
The IUPAC name of 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide (CID 11955881) is 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide.
What is the SMILES notation for 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide?
The canonical SMILES for 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide is Cc1ccccc1NNC(=O)C1(C)CCCCC1.
What is the InChIKey of 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide?
The InChIKey is JWCPNGHLMPZESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-8-4-5-9-13(12)16-17-14(18)15(2)10-6-3-7-11-15/h4-5,8-9,16H,3,6-7,10-11H2,1-2H3,(H,17,18).
What are the key properties of 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide?
1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide has a molecular weight of 246.35 g/mol, XLogP of 3.41, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N'-(2-methylphenyl)cyclohexane-1-carbohydrazide is sourced from PubChem (CID 11955881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).