(2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide

C24H21NO2 — CID 99942620

IUPAC(2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide
SMILESCC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C24H21NO2/c1-2-23(27-22-14-12-18-8-4-6-10-20(18)16-22)24(26)25-21-13-11-17-7-3-5-9-19(17)15-21/h3-16,23H,2H2,1H3,(H,25,26)/t23-/m0/s1
InChIKeyXMZJVLFSRNTRBN-QHCPKHFHSA-N
MW355.44 g/mol
LogP5.79
Rot. Bonds5

About (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide

(2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide (PubChem CID 99942620) has the molecular formula C24H21NO2 and a molecular weight of 355.44 g/mol. Its IUPAC name is (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide.

Molecular Properties

Compound Name(2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide
PubChem CID99942620
Molecular FormulaC24H21NO2
Molecular Weight355.44 g/mol
Exact Mass355.16
IUPAC Name(2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide
SMILESCC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C24H21NO2/c1-2-23(27-22-14-12-18-8-4-6-10-20(18)16-22)24(26)25-21-13-11-17-7-3-5-9-19(17)15-21/h3-16,23H,2H2,1H3,(H,25,26)/t23-/m0/s1
InChIKeyXMZJVLFSRNTRBN-QHCPKHFHSA-N
XLogP5.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.44
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-naphthalen-2-yl-2-phenoxybutanamide
CID 896831
(2S)-2-(3,4-dimethylphenoxy)-N-naphthalen-2-ylbutanamide
CID 28636461
N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide
CID 43904923
N-(4-ethoxyphenyl)-2-naphthalen-2-yloxybutanamide
CID 53284524
(2S)-N-(3-chloro-4-methylphenyl)-2-naphthalen-2-yloxybutanamide
CID 94016054
methyl 4-(2-naphthalen-2-yloxybutanoylamino)benzoate
CID 43904604
(2R)-N-(3-methoxyphenyl)-2-naphthalen-2-yloxybutanamide
CID 38010628
methyl 4-[[(2R)-2-naphthalen-2-yloxybutanoyl]amino]benzoate
CID 30382427
(2S)-N-(3-methoxyphenyl)-2-naphthalen-2-yloxybutanamide
CID 38010633
2-naphthalen-2-yloxy-N-[4-(trifluoromethyl)phenyl]butanamide
CID 17071471
(2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide
CID 28573574
(2S)-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-naphthalen-2-yloxybutanamide
CID 92680808

Frequently Asked Questions

What is the IUPAC name of (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide?
The IUPAC name of (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide (CID 99942620) is (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide.
What is the SMILES notation for (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide?
The canonical SMILES for (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide is CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc2ccccc2c1.
What is the InChIKey of (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide?
The InChIKey is XMZJVLFSRNTRBN-QHCPKHFHSA-N. The full InChI is InChI=1S/C24H21NO2/c1-2-23(27-22-14-12-18-8-4-6-10-20(18)16-22)24(26)25-21-13-11-17-7-3-5-9-19(17)15-21/h3-16,23H,2H2,1H3,(H,25,26)/t23-/m0/s1.
What are the key properties of (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide?
(2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide has a molecular weight of 355.44 g/mol, XLogP of 5.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide is sourced from PubChem (CID 99942620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).