(2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide

C19H23NO4 — CID 42082583

IUPAC(2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide
SMILESCCOc1ccc(NC(=O)[C@@H](CC)Oc2ccc(OC)cc2)cc1
InChIInChI=1S/C19H23NO4/c1-4-18(24-17-12-10-15(22-3)11-13-17)19(21)20-14-6-8-16(9-7-14)23-5-2/h6-13,18H,4-5H2,1-3H3,(H,20,21)/t18-/m1/s1
InChIKeyHMEZIBQWODMBFL-GOSISDBHSA-N
MW329.40 g/mol
LogP3.89
Rot. Bonds8

About (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide

(2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide (PubChem CID 42082583) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide.

Molecular Properties

Compound Name(2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide
PubChem CID42082583
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name(2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide
SMILESCCOc1ccc(NC(=O)[C@@H](CC)Oc2ccc(OC)cc2)cc1
InChIInChI=1S/C19H23NO4/c1-4-18(24-17-12-10-15(22-3)11-13-17)19(21)20-14-6-8-16(9-7-14)23-5-2/h6-13,18H,4-5H2,1-3H3,(H,20,21)/t18-/m1/s1
InChIKeyHMEZIBQWODMBFL-GOSISDBHSA-N
XLogP3.89
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide?
The IUPAC name of (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide (CID 42082583) is (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide.
What is the SMILES notation for (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide?
The canonical SMILES for (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide is CCOc1ccc(NC(=O)[C@@H](CC)Oc2ccc(OC)cc2)cc1.
What is the InChIKey of (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide?
The InChIKey is HMEZIBQWODMBFL-GOSISDBHSA-N. The full InChI is InChI=1S/C19H23NO4/c1-4-18(24-17-12-10-15(22-3)11-13-17)19(21)20-14-6-8-16(9-7-14)23-5-2/h6-13,18H,4-5H2,1-3H3,(H,20,21)/t18-/m1/s1.
What are the key properties of (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide?
(2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide has a molecular weight of 329.40 g/mol, XLogP of 3.89, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-ethoxyphenyl)-2-(4-methoxyphenoxy)butanamide is sourced from PubChem (CID 42082583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).