2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide

C19H20F2N2O2 — CID 113165936

IUPAC2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide
SMILESCC(=O)N(CCCc1ccccc1)CC(=O)Nc1c(F)cccc1F
InChIInChI=1S/C19H20F2N2O2/c1-14(24)23(12-6-9-15-7-3-2-4-8-15)13-18(25)22-19-16(20)10-5-11-17(19)21/h2-5,7-8,10-11H,6,9,12-13H2,1H3,(H,22,25)
InChIKeyQPSSYGMZVAHWQD-UHFFFAOYSA-N
MW346.38 g/mol
LogP3.38
Rot. Bonds7

About 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide

2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide (PubChem CID 113165936) has the molecular formula C19H20F2N2O2 and a molecular weight of 346.38 g/mol. Its IUPAC name is 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide
PubChem CID113165936
Molecular FormulaC19H20F2N2O2
Molecular Weight346.38 g/mol
Exact Mass346.15
IUPAC Name2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide
SMILESCC(=O)N(CCCc1ccccc1)CC(=O)Nc1c(F)cccc1F
InChIInChI=1S/C19H20F2N2O2/c1-14(24)23(12-6-9-15-7-3-2-4-8-15)13-18(25)22-19-16(20)10-5-11-17(19)21/h2-5,7-8,10-11H,6,9,12-13H2,1H3,(H,22,25)
InChIKeyQPSSYGMZVAHWQD-UHFFFAOYSA-N
XLogP3.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-(2,6-difluorophenyl)acetamide
CID 113160577
2-[acetyl(3-phenylpropyl)amino]-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 113165811
N-(4-acetylphenyl)-2-[acetyl(3-phenylpropyl)amino]acetamide
CID 113165901
2-[acetyl(3-phenylpropyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 113165897
2-[acetyl(3-phenylpropyl)amino]-N-(3-bromophenyl)acetamide
CID 113165914
2-[acetyl-[2-(4-fluorophenyl)ethyl]amino]-N-(2,6-dimethylphenyl)acetamide
CID 113164396
2-[acetyl(3-phenylpropyl)amino]-N-(2,4-dimethylphenyl)acetamide
CID 113165855
2-[acetyl(3-phenylpropyl)amino]-N-(4-cyanophenyl)acetamide
CID 113165933
3-[acetyl(3-phenylpropyl)amino]-N-(2,6-dichlorophenyl)propanamide
CID 113122328
2-[acetyl-[2-(4-fluorophenyl)ethyl]amino]-N-(2-fluorophenyl)acetamide
CID 113164409
2-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 113164231
N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide
CID 113164087

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide?
The IUPAC name of 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide (CID 113165936) is 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide.
What is the SMILES notation for 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide?
The canonical SMILES for 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide is CC(=O)N(CCCc1ccccc1)CC(=O)Nc1c(F)cccc1F.
What is the InChIKey of 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide?
The InChIKey is QPSSYGMZVAHWQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F2N2O2/c1-14(24)23(12-6-9-15-7-3-2-4-8-15)13-18(25)22-19-16(20)10-5-11-17(19)21/h2-5,7-8,10-11H,6,9,12-13H2,1H3,(H,22,25).
What are the key properties of 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide?
2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide has a molecular weight of 346.38 g/mol, XLogP of 3.38, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(3-phenylpropyl)amino]-N-(2,6-difluorophenyl)acetamide is sourced from PubChem (CID 113165936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).