(2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide

C21H21FN2O2 — CID 31882368

IUPAC(2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
SMILESCOc1ccc2cc(CN(C)[C@@H](C(N)=O)c3ccc(F)cc3)ccc2c1
InChIInChI=1S/C21H21FN2O2/c1-24(20(21(23)25)15-5-8-18(22)9-6-15)13-14-3-4-17-12-19(26-2)10-7-16(17)11-14/h3-12,20H,13H2,1-2H3,(H2,23,25)/t20-/m1/s1
InChIKeyWPAARVCXQDYFRU-HXUWFJFHSA-N
MW352.41 g/mol
LogP3.65
Rot. Bonds6

About (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide

(2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide (PubChem CID 31882368) has the molecular formula C21H21FN2O2 and a molecular weight of 352.41 g/mol. Its IUPAC name is (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide.

Molecular Properties

Compound Name(2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
PubChem CID31882368
Molecular FormulaC21H21FN2O2
Molecular Weight352.41 g/mol
Exact Mass352.16
IUPAC Name(2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide
SMILESCOc1ccc2cc(CN(C)[C@@H](C(N)=O)c3ccc(F)cc3)ccc2c1
InChIInChI=1S/C21H21FN2O2/c1-24(20(21(23)25)15-5-8-18(22)9-6-15)13-14-3-4-17-12-19(26-2)10-7-16(17)11-14/h3-12,20H,13H2,1-2H3,(H2,23,25)/t20-/m1/s1
InChIKeyWPAARVCXQDYFRU-HXUWFJFHSA-N
XLogP3.65
TPSA55.56 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 ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide?
The IUPAC name of (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide (CID 31882368) is (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide.
What is the SMILES notation for (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide?
The canonical SMILES for (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide is COc1ccc2cc(CN(C)[C@@H](C(N)=O)c3ccc(F)cc3)ccc2c1.
What is the InChIKey of (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide?
The InChIKey is WPAARVCXQDYFRU-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H21FN2O2/c1-24(20(21(23)25)15-5-8-18(22)9-6-15)13-14-3-4-17-12-19(26-2)10-7-16(17)11-14/h3-12,20H,13H2,1-2H3,(H2,23,25)/t20-/m1/s1.
What are the key properties of (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide?
(2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide has a molecular weight of 352.41 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-fluorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]acetamide is sourced from PubChem (CID 31882368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).