N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide

C20H22ClNO4 — CID 15907399

IUPACN-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cc(Cl)ccc2O)cc1OC1CCCC1
InChIInChI=1S/C20H22ClNO4/c1-25-18-9-6-13(10-19(18)26-15-4-2-3-5-15)11-20(24)22-16-12-14(21)7-8-17(16)23/h6-10,12,15,23H,2-5,11H2,1H3,(H,22,24)
InChIKeyMNRCRSYCRIHKDY-UHFFFAOYSA-N
MW375.85 g/mol
LogP4.56
Rot. Bonds6

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

N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide (PubChem CID 15907399) has the molecular formula C20H22ClNO4 and a molecular weight of 375.85 g/mol. Its IUPAC name is N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide
PubChem CID15907399
Molecular FormulaC20H22ClNO4
Molecular Weight375.85 g/mol
Exact Mass375.12
IUPAC NameN-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cc(Cl)ccc2O)cc1OC1CCCC1
InChIInChI=1S/C20H22ClNO4/c1-25-18-9-6-13(10-19(18)26-15-4-2-3-5-15)11-20(24)22-16-12-14(21)7-8-17(16)23/h6-10,12,15,23H,2-5,11H2,1H3,(H,22,24)
InChIKeyMNRCRSYCRIHKDY-UHFFFAOYSA-N
XLogP4.56
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.85
LogP ≤ 54.56
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

N-(5-chloro-2-hydroxyphenyl)-4-cyclopentyloxy-3-methoxybenzamide
CID 56581323
N-(5-chloro-2-hydroxyphenyl)-2-(4-methoxyphenyl)acetamide
CID 893789
N-(5-chloro-2-hydroxyphenyl)-2-(4-chlorophenyl)acetamide
CID 1262869
N-(5-chloro-2-piperidin-1-ylphenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 26292366
N-(5-chloro-2-hydroxyphenyl)-2-(2-methoxyphenoxy)acetamide
CID 893841
2-(3,4-dimethoxyphenyl)-N-[4-[[4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-3-hydroxyphenyl]methyl]-2-hydroxyphenyl]acetamide
CID 2953970
3-(5-chloro-2-methoxyphenyl)-1-cyclopropyl-1-[(4-hydroxy-3-methoxyphenyl)methyl]urea
CID 60620419
2-(5-chloro-2-methoxyphenyl)-N-cyclopentyloxyacetamide
CID 83202101
(3-cyclopentyloxy-4-methoxyphenyl)methyl cyclohexanecarboxylate
CID 174456641
N-cycloheptyl-2-(3,4-dimethoxyphenyl)acetamide
CID 720355
N-(3,5-dichlorophenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 3482890
(3-cyclopentyloxy-4-methoxyphenyl)methylhydrazine
CID 143235659

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide?
The IUPAC name of N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide (CID 15907399) is N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide.
What is the SMILES notation for N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide?
The canonical SMILES for N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide is COc1ccc(CC(=O)Nc2cc(Cl)ccc2O)cc1OC1CCCC1.
What is the InChIKey of N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide?
The InChIKey is MNRCRSYCRIHKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClNO4/c1-25-18-9-6-13(10-19(18)26-15-4-2-3-5-15)11-20(24)22-16-12-14(21)7-8-17(16)23/h6-10,12,15,23H,2-5,11H2,1H3,(H,22,24).
What are the key properties of N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide?
N-(5-chloro-2-hydroxyphenyl)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide has a molecular weight of 375.85 g/mol, XLogP of 4.56, 6 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)-2-(3-cyclopentyloxy-4-methoxyphenyl)acetamide is sourced from PubChem (CID 15907399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).