N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide

C22H23NO2 — CID 7765844

IUPACN-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide
SMILESCC[C@@H](C)c1ccc(NC(=O)COc2cccc3ccccc23)cc1
InChIInChI=1S/C22H23NO2/c1-3-16(2)17-11-13-19(14-12-17)23-22(24)15-25-21-10-6-8-18-7-4-5-9-20(18)21/h4-14,16H,3,15H2,1-2H3,(H,23,24)/t16-/m1/s1
InChIKeyWNFGFEJDKSMTSE-MRXNPFEDSA-N
MW333.43 g/mol
LogP5.37
Rot. Bonds6

About N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide

N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide (PubChem CID 7765844) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide.

Molecular Properties

Compound NameN-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide
PubChem CID7765844
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide
SMILESCC[C@@H](C)c1ccc(NC(=O)COc2cccc3ccccc23)cc1
InChIInChI=1S/C22H23NO2/c1-3-16(2)17-11-13-19(14-12-17)23-22(24)15-25-21-10-6-8-18-7-4-5-9-20(18)21/h4-14,16H,3,15H2,1-2H3,(H,23,24)/t16-/m1/s1
InChIKeyWNFGFEJDKSMTSE-MRXNPFEDSA-N
XLogP5.37
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 ≤ 55.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-butan-2-ylphenyl)-2-[2-(2-hydroxyethoxy)phenoxy]acetamide
CID 78878842
[2-[4-[(2S)-butan-2-yl]anilino]-2-oxoethyl] naphthalene-1-carboxylate
CID 7785327
N-(4-methoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 835733
[2-[4-[(2R)-butan-2-yl]anilino]-2-oxoethyl] 2-(2-ethoxyphenoxy)acetate
CID 7844626
N-[4-(dimethylamino)phenyl]-2-naphthalen-1-yloxyacetamide
CID 2327581
2-[4-[(2S)-butan-2-yl]phenoxy]-N-naphthalen-1-ylacetamide
CID 918616
N-(3,4-diethoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 7860223
2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide
CID 21213308
2-[4-[(2S)-butan-2-yl]phenoxy]-N-(4-fluorophenyl)acetamide
CID 918574
2-[2-[(2S)-butan-2-yl]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 922510
N-[4-[(2R)-butan-2-yl]phenyl]-2-quinoxalin-2-yloxyacetamide
CID 2080749
2-[2-[(2S)-butan-2-yl]phenoxy]-N-(4-methylphenyl)acetamide
CID 833563

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide?
The IUPAC name of N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide (CID 7765844) is N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide.
What is the SMILES notation for N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide?
The canonical SMILES for N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide is CC[C@@H](C)c1ccc(NC(=O)COc2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide?
The InChIKey is WNFGFEJDKSMTSE-MRXNPFEDSA-N. The full InChI is InChI=1S/C22H23NO2/c1-3-16(2)17-11-13-19(14-12-17)23-22(24)15-25-21-10-6-8-18-7-4-5-9-20(18)21/h4-14,16H,3,15H2,1-2H3,(H,23,24)/t16-/m1/s1.
What are the key properties of N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide?
N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide has a molecular weight of 333.43 g/mol, XLogP of 5.37, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide is sourced from PubChem (CID 7765844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).