N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide

C26H29NO2 — CID 7936643

IUPACN-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide
SMILESCC(C)Cc1ccc([C@@H](C)NC(=O)COc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C26H29NO2/c1-19(2)17-21-13-15-22(16-14-21)20(3)27-26(28)18-29-25-12-8-7-11-24(25)23-9-5-4-6-10-23/h4-16,19-20H,17-18H2,1-3H3,(H,27,28)/t20-/m1/s1
InChIKeyJUTCZCHSJHAUKG-HXUWFJFHSA-N
MW387.52 g/mol
LogP5.81
Rot. Bonds8

About N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide

N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide (PubChem CID 7936643) has the molecular formula C26H29NO2 and a molecular weight of 387.52 g/mol. Its IUPAC name is N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide
PubChem CID7936643
Molecular FormulaC26H29NO2
Molecular Weight387.52 g/mol
Exact Mass387.22
IUPAC NameN-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide
SMILESCC(C)Cc1ccc([C@@H](C)NC(=O)COc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C26H29NO2/c1-19(2)17-21-13-15-22(16-14-21)20(3)27-26(28)18-29-25-12-8-7-11-24(25)23-9-5-4-6-10-23/h4-16,19-20H,17-18H2,1-3H3,(H,27,28)/t20-/m1/s1
InChIKeyJUTCZCHSJHAUKG-HXUWFJFHSA-N
XLogP5.81
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.52
LogP ≤ 55.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(2-phenylphenoxy)acetamide
CID 7948811
2-(2-hydroxyphenoxy)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 78771813
2-(2-methoxyphenoxy)-N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 2608512
N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-phenoxyacetamide
CID 42902003
2-[2-[[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxoethoxy]benzamide
CID 7283926
N-[(2S)-3-methylbutan-2-yl]-2-(2-phenylphenoxy)acetamide
CID 8923326
[2-[[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxoethyl] 4-phenylbenzoate
CID 7749840
[2-[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-2-oxoethyl] 4-phenylbenzoate
CID 7749841
(2R)-3-methyl-2-[[2-(2-phenylphenoxy)acetyl]amino]butanoic acid
CID 9157386
3-methyl-N'-[2-(2-phenylphenoxy)acetyl]butanehydrazide
CID 9470420
N-(1-methoxypropan-2-yl)-2-(2-phenylphenoxy)acetamide
CID 18166557
2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide
CID 86249193

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide?
The IUPAC name of N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide (CID 7936643) is N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide.
What is the SMILES notation for N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide?
The canonical SMILES for N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide is CC(C)Cc1ccc([C@@H](C)NC(=O)COc2ccccc2-c2ccccc2)cc1.
What is the InChIKey of N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide?
The InChIKey is JUTCZCHSJHAUKG-HXUWFJFHSA-N. The full InChI is InChI=1S/C26H29NO2/c1-19(2)17-21-13-15-22(16-14-21)20(3)27-26(28)18-29-25-12-8-7-11-24(25)23-9-5-4-6-10-23/h4-16,19-20H,17-18H2,1-3H3,(H,27,28)/t20-/m1/s1.
What are the key properties of N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide?
N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide has a molecular weight of 387.52 g/mol, XLogP of 5.81, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-phenylphenoxy)acetamide is sourced from PubChem (CID 7936643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).