(2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide

C20H25NO3 — CID 40771491

IUPAC(2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
SMILESCc1ccc(C)c(O[C@H](C)C(=O)Nc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C20H25NO3/c1-13(2)23-18-10-8-17(9-11-18)21-20(22)16(5)24-19-12-14(3)6-7-15(19)4/h6-13,16H,1-5H3,(H,21,22)/t16-/m1/s1
InChIKeyNUGQIXLFGSXSPK-MRXNPFEDSA-N
MW327.42 g/mol
LogP4.50
Rot. Bonds6

About (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide

(2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide (PubChem CID 40771491) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
PubChem CID40771491
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name(2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
SMILESCc1ccc(C)c(O[C@H](C)C(=O)Nc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C20H25NO3/c1-13(2)23-18-10-8-17(9-11-18)21-20(22)16(5)24-19-12-14(3)6-7-15(19)4/h6-13,16H,1-5H3,(H,21,22)/t16-/m1/s1
InChIKeyNUGQIXLFGSXSPK-MRXNPFEDSA-N
XLogP4.50
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dimethylphenoxy)-N-[4-[2-(2,5-dimethylphenoxy)propanoylamino]phenyl]propanamide
CID 4945097
2-(2,5-dimethylphenoxy)-N-[4-[4-[2-(2,5-dimethylphenoxy)propanoylamino]phenoxy]phenyl]propanamide
CID 4945102
N-(4-acetamidophenyl)-2-(2,5-dimethylphenoxy)propanamide
CID 4944630
(2R)-2-(2,5-dimethylphenoxy)-N-phenylpropanamide
CID 7379538
2-(2-methylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
CID 17340229
2-(2,5-dimethylphenoxy)-N-[4-(2-ethoxyethoxy)phenyl]propanamide
CID 17130600
N-[4-(dimethylamino)phenyl]-2-(2,5-dimethylphenoxy)propanamide
CID 53266988
(2S)-2-(2,5-dimethylphenoxy)-N-[4-(2-phenoxyethoxy)phenyl]propanamide
CID 9296809
4-tert-butyl-N-[4-[2-(2,5-dimethylphenoxy)propanoylamino]phenyl]benzamide
CID 17235031
(2S)-2-(3-methylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
CID 40771480
(2R)-2-(2,5-dimethylphenoxy)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 100504761
2-(2,5-dimethylphenoxy)-N-[3-(4-propan-2-yloxyphenyl)propyl]propanamide
CID 132655449

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide?
The IUPAC name of (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide (CID 40771491) is (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide.
What is the SMILES notation for (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide?
The canonical SMILES for (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide is Cc1ccc(C)c(O[C@H](C)C(=O)Nc2ccc(OC(C)C)cc2)c1.
What is the InChIKey of (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide?
The InChIKey is NUGQIXLFGSXSPK-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H25NO3/c1-13(2)23-18-10-8-17(9-11-18)21-20(22)16(5)24-19-12-14(3)6-7-15(19)4/h6-13,16H,1-5H3,(H,21,22)/t16-/m1/s1.
What are the key properties of (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide?
(2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide has a molecular weight of 327.42 g/mol, XLogP of 4.50, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,5-dimethylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide is sourced from PubChem (CID 40771491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).