(2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide

C20H17Cl2NO2 — CID 99954003

IUPAC(2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide
SMILESCC[C@@H](Oc1cccc2ccccc12)C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C20H17Cl2NO2/c1-2-18(20(24)23-17-11-10-14(21)12-16(17)22)25-19-9-5-7-13-6-3-4-8-15(13)19/h3-12,18H,2H2,1H3,(H,23,24)/t18-/m1/s1
InChIKeyVLDXGLDCALYIKT-GOSISDBHSA-N
MW374.27 g/mol
LogP5.94
Rot. Bonds5

About (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide

(2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide (PubChem CID 99954003) has the molecular formula C20H17Cl2NO2 and a molecular weight of 374.27 g/mol. Its IUPAC name is (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide.

Molecular Properties

Compound Name(2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide
PubChem CID99954003
Molecular FormulaC20H17Cl2NO2
Molecular Weight374.27 g/mol
Exact Mass373.06
IUPAC Name(2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide
SMILESCC[C@@H](Oc1cccc2ccccc12)C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C20H17Cl2NO2/c1-2-18(20(24)23-17-11-10-14(21)12-16(17)22)25-19-9-5-7-13-6-3-4-8-15(13)19/h3-12,18H,2H2,1H3,(H,23,24)/t18-/m1/s1
InChIKeyVLDXGLDCALYIKT-GOSISDBHSA-N
XLogP5.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.27
LogP ≤ 55.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-naphthalen-1-yloxybutanamide
CID 132761505
(2R)-N-(2-chlorophenyl)-2-naphthalen-1-yloxybutanamide
CID 94019163
N-(2,4-dichlorophenyl)-2-(2-methylphenoxy)butanamide
CID 4931772
(2R)-N-(2,3-dichlorophenyl)-2-naphthalen-1-yloxybutanamide
CID 28633203
(2R)-N-(2-methylsulfanylphenyl)-2-naphthalen-1-yloxybutanamide
CID 94019853
(2R)-N-(3-chloro-4-methylphenyl)-2-naphthalen-1-yloxybutanamide
CID 94018722
N-(2,4-dichlorophenyl)-2-(3,5-dimethylphenoxy)butanamide
CID 17034427
methyl 2-chloro-5-(2-naphthalen-1-yloxybutanoylamino)benzoate
CID 43915723
(2R)-N-(3-acetamidophenyl)-2-naphthalen-1-yloxybutanamide
CID 92671782
(2R)-N-methyl-2-naphthalen-1-yloxybutanamide
CID 30388203
ethyl 3-methyl-4-[[(2S)-2-naphthalen-1-yloxybutanoyl]amino]benzoate
CID 28634266
N-(4-chloro-2-methylphenyl)-2-(2-fluorophenoxy)butanamide
CID 78843004

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide?
The IUPAC name of (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide (CID 99954003) is (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide.
What is the SMILES notation for (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide?
The canonical SMILES for (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide is CC[C@@H](Oc1cccc2ccccc12)C(=O)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide?
The InChIKey is VLDXGLDCALYIKT-GOSISDBHSA-N. The full InChI is InChI=1S/C20H17Cl2NO2/c1-2-18(20(24)23-17-11-10-14(21)12-16(17)22)25-19-9-5-7-13-6-3-4-8-15(13)19/h3-12,18H,2H2,1H3,(H,23,24)/t18-/m1/s1.
What are the key properties of (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide?
(2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide has a molecular weight of 374.27 g/mol, XLogP of 5.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,4-dichlorophenyl)-2-naphthalen-1-yloxybutanamide is sourced from PubChem (CID 99954003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).