N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide

C14H19ClN2O — CID 43548756

IUPACN-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide
SMILESNc1ccc(Cl)c(NC(=O)CC2CCCCC2)c1
InChIInChI=1S/C14H19ClN2O/c15-12-7-6-11(16)9-13(12)17-14(18)8-10-4-2-1-3-5-10/h6-7,9-10H,1-5,8,16H2,(H,17,18)
InChIKeyLREJIEAYTWQACU-UHFFFAOYSA-N
MW266.77 g/mol
LogP3.83
Rot. Bonds3

About N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide

N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide (PubChem CID 43548756) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide.

Molecular Properties

Compound NameN-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide
PubChem CID43548756
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC NameN-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide
SMILESNc1ccc(Cl)c(NC(=O)CC2CCCCC2)c1
InChIInChI=1S/C14H19ClN2O/c15-12-7-6-11(16)9-13(12)17-14(18)8-10-4-2-1-3-5-10/h6-7,9-10H,1-5,8,16H2,(H,17,18)
InChIKeyLREJIEAYTWQACU-UHFFFAOYSA-N
XLogP3.83
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-amino-2-chlorophenyl)-2-cyclohexylacetamide
CID 28776891
2-cyclopentyl-N-(2,5-dichlorophenyl)acetamide
CID 7733768
N-(2-chloro-5-sulfamoylphenyl)-2-cyclohexylacetamide
CID 61130512
N-(5-amino-2-chlorophenyl)-2-(cyclopentylmethylsulfinyl)acetamide
CID 63119546
N-(5-bromo-2-chlorophenyl)-2-cyclobutylacetamide
CID 103707266
N-(5-amino-2-chlorophenyl)-2-[cycloheptyl(methyl)amino]acetamide
CID 43613723
N-(2-chloro-5-cyanophenyl)-2-cycloheptylacetamide
CID 115687176
N-(2-amino-5-chlorophenyl)-2-cycloheptylacetamide
CID 114457006
N-[2-chloro-5-[(E)-N'-hydroxycarbamimidoyl]phenyl]-2-cyclobutylacetamide
CID 103166180
N-(3-amino-2-chlorophenyl)-2-cyclohexylacetamide
CID 114270030
N-(5-amino-2-chlorophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
CID 43584042
2-cyclohexyl-N-(3,5-dichloro-2-hydroxyphenyl)acetamide
CID 107675651

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide?
The IUPAC name of N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide (CID 43548756) is N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide.
What is the SMILES notation for N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide?
The canonical SMILES for N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide is Nc1ccc(Cl)c(NC(=O)CC2CCCCC2)c1.
What is the InChIKey of N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide?
The InChIKey is LREJIEAYTWQACU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c15-12-7-6-11(16)9-13(12)17-14(18)8-10-4-2-1-3-5-10/h6-7,9-10H,1-5,8,16H2,(H,17,18).
What are the key properties of N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide?
N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide has a molecular weight of 266.77 g/mol, XLogP of 3.83, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide is sourced from PubChem (CID 43548756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).