N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide

C19H20ClNO4 — CID 56581323

IUPACN-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide
SMILESCOc1cc(C(=O)Nc2cc(Cl)ccc2O)ccc1OC1CCCC1
InChIInChI=1S/C19H20ClNO4/c1-24-18-10-12(6-9-17(18)25-14-4-2-3-5-14)19(23)21-15-11-13(20)7-8-16(15)22/h6-11,14,22H,2-5H2,1H3,(H,21,23)
InChIKeyNAYBOKXUTGDYES-UHFFFAOYSA-N
MW361.83 g/mol
LogP4.63
Rot. Bonds5

About N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide

N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide (PubChem CID 56581323) has the molecular formula C19H20ClNO4 and a molecular weight of 361.83 g/mol. Its IUPAC name is N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide
PubChem CID56581323
Molecular FormulaC19H20ClNO4
Molecular Weight361.83 g/mol
Exact Mass361.11
IUPAC NameN-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide
SMILESCOc1cc(C(=O)Nc2cc(Cl)ccc2O)ccc1OC1CCCC1
InChIInChI=1S/C19H20ClNO4/c1-24-18-10-12(6-9-17(18)25-14-4-2-3-5-14)19(23)21-15-11-13(20)7-8-16(15)22/h6-11,14,22H,2-5H2,1H3,(H,21,23)
InChIKeyNAYBOKXUTGDYES-UHFFFAOYSA-N
XLogP4.63
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.83
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-cyclopentyloxy-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-methoxybenzamide
CID 55820947
4-cyclopentyloxy-N-(2,5-dimethoxyphenyl)-3-methoxybenzamide
CID 55792810
N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide
CID 15907399
2-[2-[(4-cyclopentyloxy-3-methoxybenzoyl)amino]phenyl]acetic acid
CID 119218458
N-(5-chloro-2-hydroxyphenyl)-3,4,5-trimethoxybenzamide
CID 835945
ethane;methyl 4-cyclopentyloxy-3-methoxybenzoate
CID 144796199
N-(5-chloro-2-methoxyphenyl)-6-(cycloheptylamino)pyridine-3-carboxamide
CID 109161029
N-[2-(2-aminoethylcarbamoyl)phenyl]-4-cyclopentyloxy-3-methoxybenzamide;hydrochloride
CID 120603998
N-(5-chloro-2-hydroxyphenyl)-2,4,5-trimethoxybenzamide
CID 837991
2-(4-cyclopentyloxy-3-methoxyphenyl)-2-oxoacetic acid
CID 117414713
3-cyclopentyloxy-N-(4-fluorophenyl)-4-methoxybenzamide
CID 10404302
N-(5-chloro-2-methoxyphenyl)-5-(cyclopentylamino)pyridine-3-carboxamide
CID 109226185

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide?
The IUPAC name of N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide (CID 56581323) is N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide.
What is the SMILES notation for N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide?
The canonical SMILES for N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide is COc1cc(C(=O)Nc2cc(Cl)ccc2O)ccc1OC1CCCC1.
What is the InChIKey of N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide?
The InChIKey is NAYBOKXUTGDYES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClNO4/c1-24-18-10-12(6-9-17(18)25-14-4-2-3-5-14)19(23)21-15-11-13(20)7-8-16(15)22/h6-11,14,22H,2-5H2,1H3,(H,21,23).
What are the key properties of N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide?
N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide has a molecular weight of 361.83 g/mol, XLogP of 4.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide is sourced from PubChem (CID 56581323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).