2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide

C16H23FN2O2 — CID 113164141

IUPAC2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide
SMILESCC(=O)N(CCc1ccccc1F)CC(=O)NCC(C)C
InChIInChI=1S/C16H23FN2O2/c1-12(2)10-18-16(21)11-19(13(3)20)9-8-14-6-4-5-7-15(14)17/h4-7,12H,8-11H2,1-3H3,(H,18,21)
InChIKeyZCXARTKEQCOFOA-UHFFFAOYSA-N
MW294.37 g/mol
LogP1.99
Rot. Bonds7

About 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide

2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide (PubChem CID 113164141) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide
PubChem CID113164141
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC Name2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide
SMILESCC(=O)N(CCc1ccccc1F)CC(=O)NCC(C)C
InChIInChI=1S/C16H23FN2O2/c1-12(2)10-18-16(21)11-19(13(3)20)9-8-14-6-4-5-7-15(14)17/h4-7,12H,8-11H2,1-3H3,(H,18,21)
InChIKeyZCXARTKEQCOFOA-UHFFFAOYSA-N
XLogP1.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(1-phenylethyl)acetamide
CID 113164165
2-[acetyl(3-phenylpropyl)amino]-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 113165811
2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 113164231
3-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(1-phenylethyl)propanamide
CID 113120928
N-[2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]ethyl]-2-ethylbutanamide
CID 113055638
2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-ethoxyphenyl)acetamide
CID 113164256
2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(3-chloro-2-methylphenyl)acetamide
CID 113164244
3-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 113120993
3-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methoxyethyl)propanamide
CID 113120912
3-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(3-phenylpropyl)propanamide
CID 113120960
3-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-[(4-fluorophenyl)methyl]propanamide
CID 113120931
2-[acetyl(prop-2-enyl)amino]-N-[(2-fluorophenyl)methyl]acetamide
CID 113158508

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide (CID 113164141) is 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide is CC(=O)N(CCc1ccccc1F)CC(=O)NCC(C)C.
What is the InChIKey of 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide?
The InChIKey is ZCXARTKEQCOFOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-12(2)10-18-16(21)11-19(13(3)20)9-8-14-6-4-5-7-15(14)17/h4-7,12H,8-11H2,1-3H3,(H,18,21).
What are the key properties of 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide?
2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide has a molecular weight of 294.37 g/mol, XLogP of 1.99, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 113164141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).