N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide

C22H23NO2 — CID 43904923

IUPACN-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide
SMILESCCc1ccc(NC(=O)C(CC)Oc2ccc3ccccc3c2)cc1
InChIInChI=1S/C22H23NO2/c1-3-16-9-12-19(13-10-16)23-22(24)21(4-2)25-20-14-11-17-7-5-6-8-18(17)15-20/h5-15,21H,3-4H2,1-2H3,(H,23,24)
InChIKeyNTUCOTPRFCVALK-UHFFFAOYSA-N
MW333.43 g/mol
LogP5.20
Rot. Bonds6

About N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide

N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide (PubChem CID 43904923) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide
PubChem CID43904923
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide
SMILESCCc1ccc(NC(=O)C(CC)Oc2ccc3ccccc3c2)cc1
InChIInChI=1S/C22H23NO2/c1-3-16-9-12-19(13-10-16)23-22(24)21(4-2)25-20-14-11-17-7-5-6-8-18(17)15-20/h5-15,21H,3-4H2,1-2H3,(H,23,24)
InChIKeyNTUCOTPRFCVALK-UHFFFAOYSA-N
XLogP5.20
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.43
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide
CID 99942620
(2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide
CID 28573574
methyl 4-[[(2R)-2-naphthalen-2-yloxybutanoyl]amino]benzoate
CID 30382427
methyl 4-(2-naphthalen-2-yloxybutanoylamino)benzoate
CID 43904604
N-(4-ethoxyphenyl)-2-naphthalen-2-yloxybutanamide
CID 53284524
2-naphthalen-2-yloxy-N-[4-(trifluoromethyl)phenyl]butanamide
CID 17071471
(2S)-2-(3,4-dimethylphenoxy)-N-(4-ethylphenyl)butanamide
CID 99131438
(2R)-N-naphthalen-2-yl-2-phenoxybutanamide
CID 896831
N-(4-ethylphenyl)-2-(4-methylphenoxy)butanamide
CID 53286287
2-(4-ethylphenoxy)-N-(4-phenylmethoxyphenyl)butanamide
CID 132659062
(2S)-2-(3,4-dimethylphenoxy)-N-naphthalen-2-ylbutanamide
CID 28636461
(2S)-N-(4-ethylphenyl)-2-naphthalen-1-yloxybutanamide
CID 92683938

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide?
The IUPAC name of N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide (CID 43904923) is N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide?
The canonical SMILES for N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide is CCc1ccc(NC(=O)C(CC)Oc2ccc3ccccc3c2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide?
The InChIKey is NTUCOTPRFCVALK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2/c1-3-16-9-12-19(13-10-16)23-22(24)21(4-2)25-20-14-11-17-7-5-6-8-18(17)15-20/h5-15,21H,3-4H2,1-2H3,(H,23,24).
What are the key properties of N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide?
N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide has a molecular weight of 333.43 g/mol, XLogP of 5.20, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide is sourced from PubChem (CID 43904923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).