N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide

C16H15F2NO2 — CID 34315448

IUPACN-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide
SMILESCc1ccc(CNC(=O)COc2ccccc2F)cc1F
InChIInChI=1S/C16H15F2NO2/c1-11-6-7-12(8-14(11)18)9-19-16(20)10-21-15-5-3-2-4-13(15)17/h2-8H,9-10H2,1H3,(H,19,20)
InChIKeyOWOKVJFUIQRURI-UHFFFAOYSA-N
MW291.30 g/mol
LogP2.97
Rot. Bonds5

About N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide

N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide (PubChem CID 34315448) has the molecular formula C16H15F2NO2 and a molecular weight of 291.30 g/mol. Its IUPAC name is N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide
PubChem CID34315448
Molecular FormulaC16H15F2NO2
Molecular Weight291.30 g/mol
Exact Mass291.11
IUPAC NameN-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide
SMILESCc1ccc(CNC(=O)COc2ccccc2F)cc1F
InChIInChI=1S/C16H15F2NO2/c1-11-6-7-12(8-14(11)18)9-19-16(20)10-21-15-5-3-2-4-13(15)17/h2-8H,9-10H2,1H3,(H,19,20)
InChIKeyOWOKVJFUIQRURI-UHFFFAOYSA-N
XLogP2.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-propoxyphenoxy)acetamide
CID 24553271
2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 7700855
N-[(4-fluoro-3-methylphenyl)methyl]-2-(2-methoxyphenoxy)acetamide
CID 33304679
methyl 4-[[[2-(2-fluorophenoxy)acetyl]amino]methyl]benzoate
CID 7815449
N-[2-(3,4-difluorophenyl)ethyl]-2-(2-fluorophenoxy)acetamide
CID 110788270
N-benzyl-2-(5-fluoro-2-methylphenoxy)acetamide
CID 102975403
N-[[4-(diethylaminomethyl)phenyl]methyl]-2-(2-fluorophenoxy)acetamide
CID 8947910
2-(2-fluorophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 7700300
2-(2-fluorophenoxy)-N-[(6-methoxy-3-pyridinyl)methyl]acetamide
CID 51306226
N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
CID 18113601
N-(3H-benzimidazol-5-ylmethyl)-2-(2-fluorophenoxy)acetamide
CID 110785509
N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-methoxy-4-nitrophenoxy)acetamide
CID 60619500

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide (CID 34315448) is N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide is Cc1ccc(CNC(=O)COc2ccccc2F)cc1F.
What is the InChIKey of N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide?
The InChIKey is OWOKVJFUIQRURI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO2/c1-11-6-7-12(8-14(11)18)9-19-16(20)10-21-15-5-3-2-4-13(15)17/h2-8H,9-10H2,1H3,(H,19,20).
What are the key properties of N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide?
N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide has a molecular weight of 291.30 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 34315448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).