N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide

C20H22N2O — CID 4137154

IUPACN-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide
SMILESCC1CCC(=NNC(=O)c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C20H22N2O/c1-15-7-13-19(14-8-15)21-22-20(23)18-11-9-17(10-12-18)16-5-3-2-4-6-16/h2-6,9-12,15H,7-8,13-14H2,1H3,(H,22,23)/b21-19-
InChIKeyZPARGLBUSICUIE-VZCXRCSSSA-N
MW306.41 g/mol
LogP4.65
Rot. Bonds3

About N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide

N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide (PubChem CID 4137154) has the molecular formula C20H22N2O and a molecular weight of 306.41 g/mol. Its IUPAC name is N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide
PubChem CID4137154
Molecular FormulaC20H22N2O
Molecular Weight306.41 g/mol
Exact Mass306.17
IUPAC NameN-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide
SMILESCC1CCC(=NNC(=O)c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C20H22N2O/c1-15-7-13-19(14-8-15)21-22-20(23)18-11-9-17(10-12-18)16-5-3-2-4-6-16/h2-6,9-12,15H,7-8,13-14H2,1H3,(H,22,23)/b21-19-
InChIKeyZPARGLBUSICUIE-VZCXRCSSSA-N
XLogP4.65
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(4-methylcyclohexylidene)amino]-4-[(5-phenyltetrazol-2-yl)methyl]benzamide
CID 7933017
1-N,4-N-bis[(4-phenylcyclohexylidene)amino]benzene-1,4-dicarboxamide
CID 4994656
4-phenyl-N-[(1-propan-2-ylpiperidin-4-ylidene)amino]benzamide
CID 5199563
N-[(4-methylcyclohexylidene)amino]pyridine-3-carboxamide
CID 4124153
4-amino-N-[(4-phenylcyclohexylidene)amino]benzamide
CID 9070972
N-(cyclododecylideneamino)benzamide
CID 4147051
N-[(4-ethylcyclohexylidene)amino]-4-methylbenzamide
CID 3680636
N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]benzamide
CID 5240480
3,4,5-triethoxy-N-[(4-methylcyclohexylidene)amino]benzamide
CID 5102951
N-[(E)-(3,3,5-trimethylcyclohexylidene)amino]benzamide
CID 6020523
4-hydroxy-N-[(E)-[(3S)-3-methylcyclohexylidene]amino]benzamide
CID 6339655
2-(2-methoxyphenoxy)-N-[(4-methylcyclohexylidene)amino]acetamide
CID 9315773

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide?
The IUPAC name of N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide (CID 4137154) is N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide.
What is the SMILES notation for N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide?
The canonical SMILES for N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide is CC1CCC(=NNC(=O)c2ccc(-c3ccccc3)cc2)CC1.
What is the InChIKey of N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide?
The InChIKey is ZPARGLBUSICUIE-VZCXRCSSSA-N. The full InChI is InChI=1S/C20H22N2O/c1-15-7-13-19(14-8-15)21-22-20(23)18-11-9-17(10-12-18)16-5-3-2-4-6-16/h2-6,9-12,15H,7-8,13-14H2,1H3,(H,22,23)/b21-19-.
What are the key properties of N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide?
N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide has a molecular weight of 306.41 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylcyclohexylidene)amino]-4-phenylbenzamide is sourced from PubChem (CID 4137154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).