(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide

C18H19Cl2NO2 — CID 1335441

IUPAC(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO2/c1-11(2)13-4-7-15(8-5-13)21-18(22)12(3)23-17-9-6-14(19)10-16(17)20/h4-12H,1-3H3,(H,21,22)/t12-/m1/s1
InChIKeyXDUFQZONFKHCMN-GFCCVEGCSA-N
MW352.26 g/mol
LogP5.52
Rot. Bonds5

About (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide

(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide (PubChem CID 1335441) has the molecular formula C18H19Cl2NO2 and a molecular weight of 352.26 g/mol. Its IUPAC name is (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide
PubChem CID1335441
Molecular FormulaC18H19Cl2NO2
Molecular Weight352.26 g/mol
Exact Mass351.08
IUPAC Name(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO2/c1-11(2)13-4-7-15(8-5-13)21-18(22)12(3)23-17-9-6-14(19)10-16(17)20/h4-12H,1-3H3,(H,21,22)/t12-/m1/s1
InChIKeyXDUFQZONFKHCMN-GFCCVEGCSA-N
XLogP5.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.26
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]phenyl]-2-methylpropanamide
CID 1293450
(2R)-N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 1010932
N-(4-bromophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 2725599
(2R)-2-(2,4-dichlorophenoxy)-N-(4-methoxyphenyl)propanamide
CID 697237
2,4-dichloro-N-[4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]phenyl]benzamide
CID 42561530
(2R)-N-[4-(carbamothioylamino)phenyl]-2-(2,4-dichlorophenoxy)propanamide
CID 40652778
methyl 4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]benzoate
CID 1010111
(2R)-2-(2,4-dichlorophenoxy)-N-naphthalen-2-ylpropanamide
CID 7723467
2-(2,4-dichlorophenoxy)-N-[4-(difluoromethoxy)phenyl]propanamide
CID 42989366
(2S)-2-(2,4-dichlorophenoxy)-N-(3,4-dimethylphenyl)propanamide
CID 909534
(2R)-2-(2-chloro-4-nitrophenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 7865944
2-chloro-4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]benzoic acid
CID 28677019

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide?
The IUPAC name of (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide (CID 1335441) is (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide.
What is the SMILES notation for (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide?
The canonical SMILES for (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide is CC(C)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1.
What is the InChIKey of (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide?
The InChIKey is XDUFQZONFKHCMN-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H19Cl2NO2/c1-11(2)13-4-7-15(8-5-13)21-18(22)12(3)23-17-9-6-14(19)10-16(17)20/h4-12H,1-3H3,(H,21,22)/t12-/m1/s1.
What are the key properties of (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide?
(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide has a molecular weight of 352.26 g/mol, XLogP of 5.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 1335441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).