N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide

C21H21FN2O2 — CID 9054040

IUPACN-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
SMILESCOc1ccc2cc(CN(C)CC(=O)Nc3ccccc3F)ccc2c1
InChIInChI=1S/C21H21FN2O2/c1-24(14-21(25)23-20-6-4-3-5-19(20)22)13-15-7-8-17-12-18(26-2)10-9-16(17)11-15/h3-12H,13-14H2,1-2H3,(H,23,25)
InChIKeyPHLBRSMDBHTJEH-UHFFFAOYSA-N
MW352.41 g/mol
LogP4.06
Rot. Bonds6

About N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide

N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide (PubChem CID 9054040) has the molecular formula C21H21FN2O2 and a molecular weight of 352.41 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
PubChem CID9054040
Molecular FormulaC21H21FN2O2
Molecular Weight352.41 g/mol
Exact Mass352.16
IUPAC NameN-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
SMILESCOc1ccc2cc(CN(C)CC(=O)Nc3ccccc3F)ccc2c1
InChIInChI=1S/C21H21FN2O2/c1-24(14-21(25)23-20-6-4-3-5-19(20)22)13-15-7-8-17-12-18(26-2)10-9-16(17)11-15/h3-12H,13-14H2,1-2H3,(H,23,25)
InChIKeyPHLBRSMDBHTJEH-UHFFFAOYSA-N
XLogP4.06
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.41
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluoro-4-methylphenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 9054134
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 8924997
N-(2,3-dimethylphenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 9053927
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 9053961
N-[2-(2-fluorophenyl)ethyl]-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 8925417
N-(2,5-difluorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8778357
N-(5-chloro-2-methylphenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
CID 9053943
N-(4-chloro-2-fluorophenyl)-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide
CID 17487361
N-(2-fluorophenyl)-2-[methyl(quinolin-6-ylmethyl)amino]acetamide
CID 134702606
2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(4-methoxy-2-nitrophenyl)acetamide
CID 9054049
N-(2-chlorophenyl)-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8761356
[2-(2-fluoroanilino)-2-oxoethyl]-[(6-methoxynaphthalen-2-yl)methyl]-methylazanium
CID 9054039

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide (CID 9054040) is N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide is COc1ccc2cc(CN(C)CC(=O)Nc3ccccc3F)ccc2c1.
What is the InChIKey of N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide?
The InChIKey is PHLBRSMDBHTJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21FN2O2/c1-24(14-21(25)23-20-6-4-3-5-19(20)22)13-15-7-8-17-12-18(26-2)10-9-16(17)11-15/h3-12H,13-14H2,1-2H3,(H,23,25).
What are the key properties of N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide?
N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide has a molecular weight of 352.41 g/mol, XLogP of 4.06, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide is sourced from PubChem (CID 9054040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).