2-(4-ethoxyanilino)cyclohexan-1-ol

C14H21NO2 — CID 60883757

IUPAC2-(4-ethoxyanilino)cyclohexan-1-ol
SMILESCCOc1ccc(NC2CCCCC2O)cc1
InChIInChI=1S/C14H21NO2/c1-2-17-12-9-7-11(8-10-12)15-13-5-3-4-6-14(13)16/h7-10,13-16H,2-6H2,1H3
InChIKeyUFGVWWYIUCVXEX-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.80
Rot. Bonds4

About 2-(4-ethoxyanilino)cyclohexan-1-ol

2-(4-ethoxyanilino)cyclohexan-1-ol (PubChem CID 60883757) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(4-ethoxyanilino)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(4-ethoxyanilino)cyclohexan-1-ol
PubChem CID60883757
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(4-ethoxyanilino)cyclohexan-1-ol
SMILESCCOc1ccc(NC2CCCCC2O)cc1
InChIInChI=1S/C14H21NO2/c1-2-17-12-9-7-11(8-10-12)15-13-5-3-4-6-14(13)16/h7-10,13-16H,2-6H2,1H3
InChIKeyUFGVWWYIUCVXEX-UHFFFAOYSA-N
XLogP2.80
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze 2-(4-ethoxyanilino)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

trans-(1R,2R)-2-(4-methoxyanilino)cyclooctan-1-ol
CID 15891180
2-(4-ethoxyphenoxy)-N-[(1S,2S)-2-hydroxycyclohexyl]acetamide
CID 104956604
ethyl 4-[[(1S,2S)-2-hydroxycyclohexyl]amino]benzoate
CID 56654570
(1R)-2-(4-methylanilino)cyclohexan-1-ol
CID 134547011
1-(4-ethoxyphenyl)-3-[(1R,2S)-2-methylcyclohexyl]thiourea
CID 7941815
2-(4-tert-butylanilino)cyclohexan-1-ol
CID 60884412
trans-(1S,2S)-2-(4-propylanilino)cyclopentan-1-ol
CID 102733091
trans-(1R,2R)-2-(4-propylanilino)cyclopentan-1-ol
CID 102733092
trans-(1S,2S)-2-(4-methylanilino)cyclopentan-1-ol
CID 93345908
2-(4-aminoanilino)cyclohexan-1-ol
CID 62358477
N-(4-ethoxyphenyl)-1-azabicyclo[2.2.2]octan-3-amine
CID 43121545
4-N-(4-ethoxyphenyl)-1-N-methylcyclohexane-1,4-diamine
CID 117027472

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyanilino)cyclohexan-1-ol?
The IUPAC name of 2-(4-ethoxyanilino)cyclohexan-1-ol (CID 60883757) is 2-(4-ethoxyanilino)cyclohexan-1-ol.
What is the SMILES notation for 2-(4-ethoxyanilino)cyclohexan-1-ol?
The canonical SMILES for 2-(4-ethoxyanilino)cyclohexan-1-ol is CCOc1ccc(NC2CCCCC2O)cc1.
What is the InChIKey of 2-(4-ethoxyanilino)cyclohexan-1-ol?
The InChIKey is UFGVWWYIUCVXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-2-17-12-9-7-11(8-10-12)15-13-5-3-4-6-14(13)16/h7-10,13-16H,2-6H2,1H3.
What are the key properties of 2-(4-ethoxyanilino)cyclohexan-1-ol?
2-(4-ethoxyanilino)cyclohexan-1-ol has a molecular weight of 235.33 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyanilino)cyclohexan-1-ol is sourced from PubChem (CID 60883757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).