2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide

C18H19NO4 — CID 139011396

IUPAC2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide
SMILESCOc1ccc(C2(NC(=O)c3ccc(OC)cc3O)CC2)cc1
InChIInChI=1S/C18H19NO4/c1-22-13-5-3-12(4-6-13)18(9-10-18)19-17(21)15-8-7-14(23-2)11-16(15)20/h3-8,11,20H,9-10H2,1-2H3,(H,19,21)
InChIKeyCUZZVFPEHLVHLZ-UHFFFAOYSA-N
MW313.35 g/mol
LogP2.83
Rot. Bonds5

About 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide

2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide (PubChem CID 139011396) has the molecular formula C18H19NO4 and a molecular weight of 313.35 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide
PubChem CID139011396
Molecular FormulaC18H19NO4
Molecular Weight313.35 g/mol
Exact Mass313.13
IUPAC Name2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide
SMILESCOc1ccc(C2(NC(=O)c3ccc(OC)cc3O)CC2)cc1
InChIInChI=1S/C18H19NO4/c1-22-13-5-3-12(4-6-13)18(9-10-18)19-17(21)15-8-7-14(23-2)11-16(15)20/h3-8,11,20H,9-10H2,1-2H3,(H,19,21)
InChIKeyCUZZVFPEHLVHLZ-UHFFFAOYSA-N
XLogP2.83
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.35
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,3,4-trifluoro-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide
CID 113091163
2-hydroxy-4-methoxy-N-(1-methylcyclobutyl)benzamide
CID 113346628
N-[1-(bromomethyl)cyclopentyl]-2-hydroxy-4-methoxybenzamide
CID 114311329
N-[1-(4-fluorophenyl)cyclopropyl]-4-methoxybenzamide
CID 110440290
N-[1-(chloromethyl)cyclohexyl]-2-hydroxy-4-methoxybenzamide
CID 114303332
[1-[4-(4-methoxyphenyl)phenyl]cyclopropyl]carbamic acid
CID 121483236
N-[1-(4-methoxyphenyl)cyclopropyl]propanamide
CID 113091106
2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 23249025
N-[1-(4-methoxyphenyl)cyclopropyl]thiophene-2-carboxamide
CID 113091117
N-[1-(aminomethyl)-4-methylcyclohexyl]-2-hydroxy-4-methoxybenzamide
CID 63767056
2-amino-N-[1-(3-chlorophenyl)cyclopropyl]-4-methoxybenzamide
CID 110451706
ethyl N-[1-(4-methoxyphenyl)cyclopropyl]carbamate
CID 113091172

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide (CID 139011396) is 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide is COc1ccc(C2(NC(=O)c3ccc(OC)cc3O)CC2)cc1.
What is the InChIKey of 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide?
The InChIKey is CUZZVFPEHLVHLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO4/c1-22-13-5-3-12(4-6-13)18(9-10-18)19-17(21)15-8-7-14(23-2)11-16(15)20/h3-8,11,20H,9-10H2,1-2H3,(H,19,21).
What are the key properties of 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide?
2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide has a molecular weight of 313.35 g/mol, XLogP of 2.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methoxy-N-[1-(4-methoxyphenyl)cyclopropyl]benzamide is sourced from PubChem (CID 139011396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).