(2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide

C20H25NO2 — CID 99132972

IUPAC(2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide
SMILESCCc1ccc(O[C@H](CC)C(=O)NCc2ccc(C)cc2)cc1
InChIInChI=1S/C20H25NO2/c1-4-16-10-12-18(13-11-16)23-19(5-2)20(22)21-14-17-8-6-15(3)7-9-17/h6-13,19H,4-5,14H2,1-3H3,(H,21,22)/t19-/m1/s1
InChIKeyYYVUZSFAJISNMG-LJQANCHMSA-N
MW311.43 g/mol
LogP4.03
Rot. Bonds7

About (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide

(2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide (PubChem CID 99132972) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide.

Molecular Properties

Compound Name(2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide
PubChem CID99132972
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name(2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide
SMILESCCc1ccc(O[C@H](CC)C(=O)NCc2ccc(C)cc2)cc1
InChIInChI=1S/C20H25NO2/c1-4-16-10-12-18(13-11-16)23-19(5-2)20(22)21-14-17-8-6-15(3)7-9-17/h6-13,19H,4-5,14H2,1-3H3,(H,21,22)/t19-/m1/s1
InChIKeyYYVUZSFAJISNMG-LJQANCHMSA-N
XLogP4.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methoxyphenoxy)-N-[(4-methylphenyl)methyl]butanamide
CID 21368209
(2R)-2-(4-chlorophenoxy)-N-[(4-methylphenyl)methyl]butanamide
CID 9173431
(2R)-2-(4-ethylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]butanamide
CID 99132925
2-(4-tert-butylphenoxy)-N-[(4-methylphenyl)methyl]butanamide
CID 132652045
N-[(4-ethoxyphenyl)methyl]-2-(4-ethylphenoxy)butanamide
CID 53288894
N-[(4-methylphenyl)methyl]-2-naphthalen-2-yloxybutanamide
CID 43876560
(2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-2-yloxybutanamide
CID 28575311
(2S)-2-(4-methylphenoxy)-N-[2-[[(2S)-2-(4-methylphenoxy)butanoyl]amino]ethyl]butanamide
CID 40796762
N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide
CID 53286287
2-(4-chloro-3-methylphenoxy)-N-[(4-methylphenyl)methyl]butanamide
CID 13232165
2-phenoxy-N-[(4-propan-2-yloxyphenyl)methyl]butanamide
CID 43911069
(2R)-N-[(3-ethoxyphenyl)methyl]-2-(4-ethylphenoxy)butanamide
CID 99133064

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide?
The IUPAC name of (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide (CID 99132972) is (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide.
What is the SMILES notation for (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide?
The canonical SMILES for (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide is CCc1ccc(O[C@H](CC)C(=O)NCc2ccc(C)cc2)cc1.
What is the InChIKey of (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide?
The InChIKey is YYVUZSFAJISNMG-LJQANCHMSA-N. The full InChI is InChI=1S/C20H25NO2/c1-4-16-10-12-18(13-11-16)23-19(5-2)20(22)21-14-17-8-6-15(3)7-9-17/h6-13,19H,4-5,14H2,1-3H3,(H,21,22)/t19-/m1/s1.
What are the key properties of (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide?
(2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide has a molecular weight of 311.43 g/mol, XLogP of 4.03, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-ethylphenoxy)-N-[(4-methylphenyl)methyl]butanamide is sourced from PubChem (CID 99132972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).