1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol

C15H21NO — CID 10466452

IUPAC1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol
SMILESCc1cccc(C)c1/N=C/C1(O)CCCCC1
InChIInChI=1S/C15H21NO/c1-12-7-6-8-13(2)14(12)16-11-15(17)9-4-3-5-10-15/h6-8,11,17H,3-5,9-10H2,1-2H3/b16-11+
InChIKeyGYKRHUQIYWRGNP-LFIBNONCSA-N
MW231.34 g/mol
LogP3.70
Rot. Bonds2

About 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol

1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol (PubChem CID 10466452) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol
PubChem CID10466452
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol
SMILESCc1cccc(C)c1/N=C/C1(O)CCCCC1
InChIInChI=1S/C15H21NO/c1-12-7-6-8-13(2)14(12)16-11-15(17)9-4-3-5-10-15/h6-8,11,17H,3-5,9-10H2,1-2H3/b16-11+
InChIKeyGYKRHUQIYWRGNP-LFIBNONCSA-N
XLogP3.70
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-N-(2,6-dimethylphenyl)but-2-en-1-imine
CID 12818328
1-[N-(2,6-dimethylphenyl)-C-(trifluoromethyl)carbonimidoyl]cyclohexan-1-ol
CID 11120097
2-(1-hydroxycyclohexyl)-6-methylphenol
CID 117104328
N-(2,6-dimethylphenyl)ethanimine
CID 10993945
N,N'-bis(2,6-dimethylphenyl)ethane-1,2-diimine;carbanide;nickel
CID 59881388
2-(1-hydroxycyclopentyl)-3-methylphenol
CID 117104122
acetylene;N-(2,6-dimethylphenyl)ethanimine
CID 142169551
1-(2-bromo-6-methylphenyl)cyclohexan-1-ol
CID 117104241
1-[(2,6-dimethylanilino)methyl]cyclohexan-1-ol
CID 62332412
1-(2,4,5-trimethylphenyl)cycloheptan-1-ol
CID 64985087
2-chloro-N-(2,6-dimethylphenyl)ethanimine
CID 101094271
5-(2,6-dimethylphenyl)imino-2-[(2,6-dimethylphenyl)iminomethyl]-3-methyl-4-phenyl-1-propan-2-ylpyrrol-2-ol
CID 10600257

Frequently Asked Questions

What is the IUPAC name of 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol?
The IUPAC name of 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol (CID 10466452) is 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol is Cc1cccc(C)c1/N=C/C1(O)CCCCC1.
What is the InChIKey of 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol?
The InChIKey is GYKRHUQIYWRGNP-LFIBNONCSA-N. The full InChI is InChI=1S/C15H21NO/c1-12-7-6-8-13(2)14(12)16-11-15(17)9-4-3-5-10-15/h6-8,11,17H,3-5,9-10H2,1-2H3/b16-11+.
What are the key properties of 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol?
1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol has a molecular weight of 231.34 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,6-dimethylphenyl)iminomethyl]cyclohexan-1-ol is sourced from PubChem (CID 10466452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).