2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide

C22H22N2O3 — CID 21213308

IUPAC2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide
SMILESCC(C)C(=O)Nc1cccc(NC(=O)COc2cccc3ccccc23)c1
InChIInChI=1S/C22H22N2O3/c1-15(2)22(26)24-18-10-6-9-17(13-18)23-21(25)14-27-20-12-5-8-16-7-3-4-11-19(16)20/h3-13,15H,14H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyNQEQVLPUGQZTLF-UHFFFAOYSA-N
MW362.43 g/mol
LogP4.45
Rot. Bonds6

About 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide

2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide (PubChem CID 21213308) has the molecular formula C22H22N2O3 and a molecular weight of 362.43 g/mol. Its IUPAC name is 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide
PubChem CID21213308
Molecular FormulaC22H22N2O3
Molecular Weight362.43 g/mol
Exact Mass362.16
IUPAC Name2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide
SMILESCC(C)C(=O)Nc1cccc(NC(=O)COc2cccc3ccccc23)c1
InChIInChI=1S/C22H22N2O3/c1-15(2)22(26)24-18-10-6-9-17(13-18)23-21(25)14-27-20-12-5-8-16-7-3-4-11-19(16)20/h3-13,15H,14H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyNQEQVLPUGQZTLF-UHFFFAOYSA-N
XLogP4.45
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]phenyl]-2-methylpropanamide
CID 17189164
N-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 17189278
N-(3-chlorophenyl)-2-naphthalen-1-yloxyacetamide
CID 954547
N-(3,4-diethoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 7860223
N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide
CID 7765844
N-(4-methoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 835733
N-[3-[[2-(4-bromo-2-propan-2-ylphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 17189024
N-[3-[[2-(3-methoxyphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 87016346
N-[3-[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 17189191
2-(1-bromonaphthalen-2-yl)oxy-N-(3-propan-2-yloxyphenyl)acetamide
CID 17154684
N-[4-(dimethylamino)phenyl]-2-naphthalen-1-yloxyacetamide
CID 2327581
N-[3-(2-methylpropanoylamino)phenyl]butanamide
CID 17189167

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide?
The IUPAC name of 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide (CID 21213308) is 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide.
What is the SMILES notation for 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide?
The canonical SMILES for 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide is CC(C)C(=O)Nc1cccc(NC(=O)COc2cccc3ccccc23)c1.
What is the InChIKey of 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide?
The InChIKey is NQEQVLPUGQZTLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3/c1-15(2)22(26)24-18-10-6-9-17(13-18)23-21(25)14-27-20-12-5-8-16-7-3-4-11-19(16)20/h3-13,15H,14H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide?
2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide has a molecular weight of 362.43 g/mol, XLogP of 4.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-[(2-naphthalen-1-yloxyacetyl)amino]phenyl]propanamide is sourced from PubChem (CID 21213308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).