N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide

C17H20N2O4 — CID 154939563

IUPACN-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide
SMILESCNCC(=O)Nc1ccc(Oc2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C17H20N2O4/c1-18-11-17(20)19-12-4-6-13(7-5-12)23-16-9-14(21-2)8-15(10-16)22-3/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyFQPFJISGZZANPR-UHFFFAOYSA-N
MW316.36 g/mol
LogP2.65
Rot. Bonds7

About N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide

N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide (PubChem CID 154939563) has the molecular formula C17H20N2O4 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide
PubChem CID154939563
Molecular FormulaC17H20N2O4
Molecular Weight316.36 g/mol
Exact Mass316.14
IUPAC NameN-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide
SMILESCNCC(=O)Nc1ccc(Oc2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C17H20N2O4/c1-18-11-17(20)19-12-4-6-13(7-5-12)23-16-9-14(21-2)8-15(10-16)22-3/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyFQPFJISGZZANPR-UHFFFAOYSA-N
XLogP2.65
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(methylamino)-N-[4-(4-methylphenoxy)phenyl]acetamide
CID 18084877
N-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-2-(methylamino)acetamide;hydrochloride
CID 119820030
2-[4-(3,5-dimethylphenoxy)phenoxy]-N-(4-methoxyphenyl)acetamide
CID 18870428
N-[4-(2-methoxyethoxy)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119723419
2-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)acetamide
CID 7707204
[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid
CID 67025275
2-(methylamino)-N-(4-propoxyphenyl)acetamide
CID 54820943
2-(methylamino)-N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide;hydrochloride
CID 119752817
2-(ethylamino)-N-(4-methoxyphenyl)acetamide
CID 2113294
N-[4-(3,5-dimethylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide
CID 119741341
2-(tert-butylamino)-N-(4-methoxyphenyl)acetamide
CID 27149891
2-(4-methoxyanilino)-N-phenylacetamide
CID 7636829

Frequently Asked Questions

What is the IUPAC name of N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide?
The IUPAC name of N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide (CID 154939563) is N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide?
The canonical SMILES for N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide is CNCC(=O)Nc1ccc(Oc2cc(OC)cc(OC)c2)cc1.
What is the InChIKey of N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide?
The InChIKey is FQPFJISGZZANPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4/c1-18-11-17(20)19-12-4-6-13(7-5-12)23-16-9-14(21-2)8-15(10-16)22-3/h4-10,18H,11H2,1-3H3,(H,19,20).
What are the key properties of N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide?
N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide has a molecular weight of 316.36 g/mol, XLogP of 2.65, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3,5-dimethoxyphenoxy)phenyl]-2-(methylamino)acetamide is sourced from PubChem (CID 154939563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).