N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide

C21H26N2O4 — CID 46948281

IUPACN-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)C2(C)CCN2CCOc2ccccc2)c1
InChIInChI=1S/C21H26N2O4/c1-21(11-12-23(21)13-14-27-16-7-5-4-6-8-16)20(24)22-18-15-17(25-2)9-10-19(18)26-3/h4-10,15H,11-14H2,1-3H3,(H,22,24)
InChIKeyOKBBNDRNXDDHOW-UHFFFAOYSA-N
MW370.45 g/mol
LogP3.19
Rot. Bonds8

About N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide

N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide (PubChem CID 46948281) has the molecular formula C21H26N2O4 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide
PubChem CID46948281
Molecular FormulaC21H26N2O4
Molecular Weight370.45 g/mol
Exact Mass370.19
IUPAC NameN-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)C2(C)CCN2CCOc2ccccc2)c1
InChIInChI=1S/C21H26N2O4/c1-21(11-12-23(21)13-14-27-16-7-5-4-6-8-16)20(24)22-18-15-17(25-2)9-10-19(18)26-3/h4-10,15H,11-14H2,1-3H3,(H,22,24)
InChIKeyOKBBNDRNXDDHOW-UHFFFAOYSA-N
XLogP3.19
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide
CID 17034633
1-N-(2,5-dimethoxyphenyl)-1-N'-methyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108980986
1-N-(3-acetamidophenyl)-1-N'-(2,5-dimethoxyphenyl)cyclopropane-1,1-dicarboxamide
CID 108983285
1-N'-(2,5-dimethoxyphenyl)-1-N-(2,3-dimethylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981643
2-(2,5-dimethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 54814166
2-(2,5-dimethoxyanilino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54814109
2-[2-[(2,5-dimethoxyphenyl)carbamoyl]phenyl]benzoic acid
CID 1348361
N-(2,5-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 676177
2-benzyl-N-(2,5-dimethoxyphenyl)-7-oxoazepane-2-carboxamide
CID 91919465
N-(2,5-dimethoxyphenyl)-2-(3-methoxyphenoxy)acetamide
CID 19204029
N-(2,5-dimethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 17355355
(2S)-N-(2,5-dimethoxyphenyl)-2-methyl-7-oxoazepane-2-carboxamide
CID 164633014

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide (CID 46948281) is N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide is COc1ccc(OC)c(NC(=O)C2(C)CCN2CCOc2ccccc2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide?
The InChIKey is OKBBNDRNXDDHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4/c1-21(11-12-23(21)13-14-27-16-7-5-4-6-8-16)20(24)22-18-15-17(25-2)9-10-19(18)26-3/h4-10,15H,11-14H2,1-3H3,(H,22,24).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide?
N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide has a molecular weight of 370.45 g/mol, XLogP of 3.19, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-methyl-1-(2-phenoxyethyl)azetidine-2-carboxamide is sourced from PubChem (CID 46948281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).