2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide

C16H23FN2O2 — CID 46980113

IUPAC2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide
SMILESCN(CC1(C)COC1)C(=O)C(c1ccc(F)cc1)N(C)C
InChIInChI=1S/C16H23FN2O2/c1-16(10-21-11-16)9-19(4)15(20)14(18(2)3)12-5-7-13(17)8-6-12/h5-8,14H,9-11H2,1-4H3
InChIKeyOCLQEMIPRPJHSZ-UHFFFAOYSA-N
MW294.37 g/mol
LogP1.92
Rot. Bonds5

About 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide

2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide (PubChem CID 46980113) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide
PubChem CID46980113
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC Name2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide
SMILESCN(CC1(C)COC1)C(=O)C(c1ccc(F)cc1)N(C)C
InChIInChI=1S/C16H23FN2O2/c1-16(10-21-11-16)9-19(4)15(20)14(18(2)3)12-5-7-13(17)8-6-12/h5-8,14H,9-11H2,1-4H3
InChIKeyOCLQEMIPRPJHSZ-UHFFFAOYSA-N
XLogP1.92
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide?
The IUPAC name of 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide (CID 46980113) is 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide.
What is the SMILES notation for 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide?
The canonical SMILES for 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide is CN(CC1(C)COC1)C(=O)C(c1ccc(F)cc1)N(C)C.
What is the InChIKey of 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide?
The InChIKey is OCLQEMIPRPJHSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-16(10-21-11-16)9-19(4)15(20)14(18(2)3)12-5-7-13(17)8-6-12/h5-8,14H,9-11H2,1-4H3.
What are the key properties of 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide?
2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide has a molecular weight of 294.37 g/mol, XLogP of 1.92, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]acetamide is sourced from PubChem (CID 46980113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).