N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide

C15H20ClNO2 — CID 106133730

IUPACN-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccccc1O)NCC1CCC(Cl)CC1
InChIInChI=1S/C15H20ClNO2/c16-13-7-5-11(6-8-13)10-17-15(19)9-12-3-1-2-4-14(12)18/h1-4,11,13,18H,5-10H2,(H,17,19)
InChIKeyUXBIMZCIMLDABV-UHFFFAOYSA-N
MW281.78 g/mol
LogP2.85
Rot. Bonds4

About N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide

N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide (PubChem CID 106133730) has the molecular formula C15H20ClNO2 and a molecular weight of 281.78 g/mol. Its IUPAC name is N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide
PubChem CID106133730
Molecular FormulaC15H20ClNO2
Molecular Weight281.78 g/mol
Exact Mass281.12
IUPAC NameN-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide
SMILESO=C(Cc1ccccc1O)NCC1CCC(Cl)CC1
InChIInChI=1S/C15H20ClNO2/c16-13-7-5-11(6-8-13)10-17-15(19)9-12-3-1-2-4-14(12)18/h1-4,11,13,18H,5-10H2,(H,17,19)
InChIKeyUXBIMZCIMLDABV-UHFFFAOYSA-N
XLogP2.85
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.78
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide 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

N-[(4-chlorocyclohexyl)methyl]-2-phenylacetamide
CID 114147876
2-(2-hydroxyphenyl)-N-(thian-4-ylmethyl)acetamide
CID 115626238
2-(2-aminophenyl)-N-(cyclopropylmethyl)acetamide
CID 16791289
N-[(4-chlorocyclohexyl)methyl]-2,3-dihydroxybenzamide
CID 106133738
N-[[4-[[(2-chlorophenyl)methylcarbamoylamino]methyl]cyclohexyl]methyl]-2-phenylacetamide
CID 23761916
2-[2-(aminomethyl)phenyl]-N-[(4-hydroxycyclohexyl)methyl]acetamide
CID 106135698
2-(2-aminophenyl)-N-[(4-hydroxycyclohexyl)methyl]acetamide
CID 106119007
N-[(4-chlorocyclohexyl)methyl]-2-(3,4-dimethylphenyl)acetamide
CID 106133406
N-[(2-bromocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide
CID 113275096
N-[(4-bromocyclohexyl)methyl]-2-phenylacetamide
CID 106134234
N-[[4-(hydroxymethyl)cyclohexyl]methyl]-2-[2-(trifluoromethyl)phenyl]acetamide
CID 91772069
N-(cycloheptylmethyl)-2-phenylacetamide
CID 54313529

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide (CID 106133730) is N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide is O=C(Cc1ccccc1O)NCC1CCC(Cl)CC1.
What is the InChIKey of N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide?
The InChIKey is UXBIMZCIMLDABV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO2/c16-13-7-5-11(6-8-13)10-17-15(19)9-12-3-1-2-4-14(12)18/h1-4,11,13,18H,5-10H2,(H,17,19).
What are the key properties of N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide?
N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide has a molecular weight of 281.78 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorocyclohexyl)methyl]-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 106133730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).