2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide

C17H21N3O — CID 62510956

IUPAC2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide
SMILESCc1ccc(NN)c(C(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C17H21N3O/c1-11(2)13-6-4-5-7-15(13)19-17(21)14-10-12(3)8-9-16(14)20-18/h4-11,20H,18H2,1-3H3,(H,19,21)
InChIKeyIFVPAWDKNLDUJS-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.66
Rot. Bonds4

About 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide

2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide (PubChem CID 62510956) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide
PubChem CID62510956
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide
SMILESCc1ccc(NN)c(C(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C17H21N3O/c1-11(2)13-6-4-5-7-15(13)19-17(21)14-10-12(3)8-9-16(14)20-18/h4-11,20H,18H2,1-3H3,(H,19,21)
InChIKeyIFVPAWDKNLDUJS-UHFFFAOYSA-N
XLogP3.66
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

2-hydrazinyl-N-(2-iodophenyl)-5-methylbenzamide
CID 62512985
N-[2-(dimethylamino)phenyl]-2-hydrazinyl-5-methylbenzamide
CID 106760779
N-(2,3-difluorophenyl)-2-hydrazinyl-5-methylbenzamide
CID 62509085
1,2,5-trimethyl-N-(2-propan-2-ylphenyl)pyrrole-3-carboxamide
CID 125145147
2-iodo-N-(2-propan-2-ylphenyl)benzamide
CID 615900
N-(3-chloro-2-fluorophenyl)-2-hydrazinyl-5-methylbenzamide
CID 62512161
2-bromo-N-[2-(1-chloroethyl)phenyl]-5-methylbenzamide
CID 114304970
5-amino-2-methyl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 61039486
2,5-dihydroxy-N-(2-propan-2-ylphenyl)benzamide
CID 103891803
N-(2-bromo-5-methylphenyl)-2-hydrazinylbenzamide
CID 82758478
N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide
CID 62243099
2,5-dichloro-N-(2-propan-2-ylphenyl)benzamide
CID 966223

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide?
The IUPAC name of 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide (CID 62510956) is 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide?
The canonical SMILES for 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide is Cc1ccc(NN)c(C(=O)Nc2ccccc2C(C)C)c1.
What is the InChIKey of 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide?
The InChIKey is IFVPAWDKNLDUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-11(2)13-6-4-5-7-15(13)19-17(21)14-10-12(3)8-9-16(14)20-18/h4-11,20H,18H2,1-3H3,(H,19,21).
What are the key properties of 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide?
2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide has a molecular weight of 283.38 g/mol, XLogP of 3.66, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-5-methyl-N-(2-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 62510956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).