N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide

C20H23ClN2O2 — CID 37231284

IUPACN-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide
SMILESCc1c(Cl)cccc1NC(=O)CNc1cccc(OC2CCCC2)c1
InChIInChI=1S/C20H23ClN2O2/c1-14-18(21)10-5-11-19(14)23-20(24)13-22-15-6-4-9-17(12-15)25-16-7-2-3-8-16/h4-6,9-12,16,22H,2-3,7-8,13H2,1H3,(H,23,24)
InChIKeyGQHHEOHEBLQBQD-UHFFFAOYSA-N
MW358.87 g/mol
LogP5.02
Rot. Bonds6

About N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide

N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide (PubChem CID 37231284) has the molecular formula C20H23ClN2O2 and a molecular weight of 358.87 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide
PubChem CID37231284
Molecular FormulaC20H23ClN2O2
Molecular Weight358.87 g/mol
Exact Mass358.14
IUPAC NameN-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide
SMILESCc1c(Cl)cccc1NC(=O)CNc1cccc(OC2CCCC2)c1
InChIInChI=1S/C20H23ClN2O2/c1-14-18(21)10-5-11-19(14)23-20(24)13-22-15-6-4-9-17(12-15)25-16-7-2-3-8-16/h4-6,9-12,16,22H,2-3,7-8,13H2,1H3,(H,23,24)
InChIKeyGQHHEOHEBLQBQD-UHFFFAOYSA-N
XLogP5.02
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.87
LogP ≤ 55.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylphenyl)-2-(3-propan-2-yloxyanilino)acetamide
CID 54830208
N-(3-chloro-2-methylphenyl)-2-[3-(2-methylpropoxy)anilino]acetamide
CID 54823958
N-(3-chloro-2-methylphenyl)-2-[3-(2-methylprop-2-enoxy)anilino]acetamide
CID 54825731
2-(3-cyclopentyloxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 37231455
2-(3-cyclopentyloxyanilino)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 37231406
N-(3-chloro-2-methylphenyl)-2-[3-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 34085061
2-(3-cyclopentyloxyanilino)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide
CID 37231421
2-(3-cyclopentyloxyanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 37231584
N-(3-chlorophenyl)-2-(2-cyclopentyloxyanilino)acetamide
CID 52704421
N-(3-cyclopentyloxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119714958
N-(3-chloro-2-methylphenyl)-2-[[(1S,2R)-2-methylcyclohexyl]amino]acetamide
CID 8009217
2-(1,3-benzodioxol-5-ylamino)-N-(3-chloro-2-methylphenyl)acetamide
CID 109008524

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide (CID 37231284) is N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide is Cc1c(Cl)cccc1NC(=O)CNc1cccc(OC2CCCC2)c1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide?
The InChIKey is GQHHEOHEBLQBQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O2/c1-14-18(21)10-5-11-19(14)23-20(24)13-22-15-6-4-9-17(12-15)25-16-7-2-3-8-16/h4-6,9-12,16,22H,2-3,7-8,13H2,1H3,(H,23,24).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide?
N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide has a molecular weight of 358.87 g/mol, XLogP of 5.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-(3-cyclopentyloxyanilino)acetamide is sourced from PubChem (CID 37231284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).