(2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide

C22H23NO2 — CID 92646424

IUPAC(2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide
SMILESCC[C@@H](Oc1cccc2ccccc12)C(=O)NCc1ccc(C)cc1
InChIInChI=1S/C22H23NO2/c1-3-20(22(24)23-15-17-13-11-16(2)12-14-17)25-21-10-6-8-18-7-4-5-9-19(18)21/h4-14,20H,3,15H2,1-2H3,(H,23,24)/t20-/m1/s1
InChIKeyUHYFSRGGUDCWDA-HXUWFJFHSA-N
MW333.43 g/mol
LogP4.62
Rot. Bonds6

About (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide

(2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide (PubChem CID 92646424) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide.

Molecular Properties

Compound Name(2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide
PubChem CID92646424
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC Name(2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide
SMILESCC[C@@H](Oc1cccc2ccccc12)C(=O)NCc1ccc(C)cc1
InChIInChI=1S/C22H23NO2/c1-3-20(22(24)23-15-17-13-11-16(2)12-14-17)25-21-10-6-8-18-7-4-5-9-19(18)21/h4-14,20H,3,15H2,1-2H3,(H,23,24)/t20-/m1/s1
InChIKeyUHYFSRGGUDCWDA-HXUWFJFHSA-N
XLogP4.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-benzyl-2-naphthalen-1-yloxybutanamide
CID 30377459
(2S)-N-[(4-fluorophenyl)methyl]-2-naphthalen-1-yloxybutanamide
CID 92674999
N-[(4-methoxyphenyl)methyl]-2-naphthalen-1-yloxybutanamide
CID 43915994
N-(naphthalen-1-ylmethyl)-2-naphthalen-1-yloxybutanamide
CID 133218992
(2S)-2-(2-chlorophenoxy)-N-[(4-methylphenyl)methyl]butanamide
CID 92683061
(2S)-N-ethyl-2-naphthalen-1-yloxybutanamide
CID 92675039
(2R)-2-naphthalen-1-yloxy-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide
CID 94015221
N-[(4-methylphenyl)methyl]-2-naphthalen-2-yloxybutanamide
CID 43876560
(2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-2-yloxybutanamide
CID 28575311
(2R)-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-2-naphthalen-1-yloxybutanamide
CID 94016431
(2S)-N-[(2-ethoxyphenyl)methyl]-2-naphthalen-1-yloxybutanamide
CID 94028066
(2R)-2-naphthalen-1-yloxy-N-(2-phenylethyl)butanamide
CID 92675290

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide?
The IUPAC name of (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide (CID 92646424) is (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide.
What is the SMILES notation for (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide?
The canonical SMILES for (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide is CC[C@@H](Oc1cccc2ccccc12)C(=O)NCc1ccc(C)cc1.
What is the InChIKey of (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide?
The InChIKey is UHYFSRGGUDCWDA-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H23NO2/c1-3-20(22(24)23-15-17-13-11-16(2)12-14-17)25-21-10-6-8-18-7-4-5-9-19(18)21/h4-14,20H,3,15H2,1-2H3,(H,23,24)/t20-/m1/s1.
What are the key properties of (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide?
(2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide has a molecular weight of 333.43 g/mol, XLogP of 4.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(4-methylphenyl)methyl]-2-naphthalen-1-yloxybutanamide is sourced from PubChem (CID 92646424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).