N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide

C17H17ClFNO — CID 12790318

IUPACN-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide
SMILESCC(C)(NC(=O)Cc1ccccc1F)c1cccc(Cl)c1
InChIInChI=1S/C17H17ClFNO/c1-17(2,13-7-5-8-14(18)11-13)20-16(21)10-12-6-3-4-9-15(12)19/h3-9,11H,10H2,1-2H3,(H,20,21)
InChIKeyLSGWVBQRMXDMOS-UHFFFAOYSA-N
MW305.78 g/mol
LogP4.07
Rot. Bonds4

About N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide

N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide (PubChem CID 12790318) has the molecular formula C17H17ClFNO and a molecular weight of 305.78 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide
PubChem CID12790318
Molecular FormulaC17H17ClFNO
Molecular Weight305.78 g/mol
Exact Mass305.10
IUPAC NameN-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide
SMILESCC(C)(NC(=O)Cc1ccccc1F)c1cccc(Cl)c1
InChIInChI=1S/C17H17ClFNO/c1-17(2,13-7-5-8-14(18)11-13)20-16(21)10-12-6-3-4-9-15(12)19/h3-9,11H,10H2,1-2H3,(H,20,21)
InChIKeyLSGWVBQRMXDMOS-UHFFFAOYSA-N
XLogP4.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.78
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-chlorophenyl)-6-fluoro-N-[[(3R,4S)-3-methylpiperidin-4-yl]methyl]benzamide
CID 46871844
2-(3-Chloro-phenyl)-N-[1-(4-fluoro-benzyl)-piperidin-4-yl]-acetamide
CID 9841846
N-[(4-chlorophenyl)methyl]-2-(4-methylphenyl)acetamide
CID 890251
N-[(3-chlorophenyl)methyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 2681219
2-(3-chlorophenyl)-6-fluoro-N-[[(3R,4R)-3-methylpiperidin-4-yl]methyl]benzamide
CID 46891075
2-(3-chlorophenyl)-6-fluoro-N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)benzamide
CID 46891076
2-(3-chlorophenyl)-N-[[(3R,4S)-3-ethylpiperidin-4-yl]methyl]-6-fluorobenzamide
CID 46891141
2-(4-tert-butylphenyl)-N-[1-(2-chlorophenyl)ethyl]acetamide
CID 53319717
2-(4-tert-butylphenyl)-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide
CID 53326846
N-[(4-chlorophenyl)methyl]-3-phenylbutanamide
CID 2915274
N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide
CID 54782252
N-[1-(4-chlorophenyl)-2,3-dimethyl-1-oxobutan-2-yl]benzamide
CID 70695208

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide (CID 12790318) is N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide is CC(C)(NC(=O)Cc1ccccc1F)c1cccc(Cl)c1.
What is the InChIKey of N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide?
The InChIKey is LSGWVBQRMXDMOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClFNO/c1-17(2,13-7-5-8-14(18)11-13)20-16(21)10-12-6-3-4-9-15(12)19/h3-9,11H,10H2,1-2H3,(H,20,21).
What are the key properties of N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide?
N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide has a molecular weight of 305.78 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)propan-2-yl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 12790318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).