N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide

C15H21ClN2O — CID 788650

IUPACN-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide
SMILESCN(CC(=O)Nc1ccc(Cl)cc1)C1CCCCC1
InChIInChI=1S/C15H21ClN2O/c1-18(14-5-3-2-4-6-14)11-15(19)17-13-9-7-12(16)8-10-13/h7-10,14H,2-6,11H2,1H3,(H,17,19)
InChIKeyKZPYNAAHAXETPZ-UHFFFAOYSA-N
MW280.80 g/mol
LogP3.54
Rot. Bonds4

About N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide

N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide (PubChem CID 788650) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide
PubChem CID788650
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC NameN-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide
SMILESCN(CC(=O)Nc1ccc(Cl)cc1)C1CCCCC1
InChIInChI=1S/C15H21ClN2O/c1-18(14-5-3-2-4-6-14)11-15(19)17-13-9-7-12(16)8-10-13/h7-10,14H,2-6,11H2,1H3,(H,17,19)
InChIKeyKZPYNAAHAXETPZ-UHFFFAOYSA-N
XLogP3.54
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide (CID 788650) is N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide is CN(CC(=O)Nc1ccc(Cl)cc1)C1CCCCC1.
What is the InChIKey of N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide?
The InChIKey is KZPYNAAHAXETPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-18(14-5-3-2-4-6-14)11-15(19)17-13-9-7-12(16)8-10-13/h7-10,14H,2-6,11H2,1H3,(H,17,19).
What are the key properties of N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide?
N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide has a molecular weight of 280.80 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[cyclohexyl(methyl)amino]acetamide is sourced from PubChem (CID 788650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).