N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide

C17H17ClFNO — CID 18158661

IUPACN-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide
SMILESCCC(NC(=O)Cc1ccccc1F)c1ccc(Cl)cc1
InChIInChI=1S/C17H17ClFNO/c1-2-16(12-7-9-14(18)10-8-12)20-17(21)11-13-5-3-4-6-15(13)19/h3-10,16H,2,11H2,1H3,(H,20,21)
InChIKeyXGTSEONYSNCWTD-UHFFFAOYSA-N
MW305.78 g/mol
LogP4.29
Rot. Bonds5

About N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide

N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide (PubChem CID 18158661) has the molecular formula C17H17ClFNO and a molecular weight of 305.78 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide
PubChem CID18158661
Molecular FormulaC17H17ClFNO
Molecular Weight305.78 g/mol
Exact Mass305.10
IUPAC NameN-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide
SMILESCCC(NC(=O)Cc1ccccc1F)c1ccc(Cl)cc1
InChIInChI=1S/C17H17ClFNO/c1-2-16(12-7-9-14(18)10-8-12)20-17(21)11-13-5-3-4-6-15(13)19/h3-10,16H,2,11H2,1H3,(H,20,21)
InChIKeyXGTSEONYSNCWTD-UHFFFAOYSA-N
XLogP4.29
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.78
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 7733439
2-(2-chlorophenyl)-N-(1-phenylpropyl)acetamide
CID 17328141
2-(2-fluorophenyl)-N-[1-(2-methylphenyl)propyl]acetamide
CID 133167009
N-[2-[[(1S)-1-(4-chlorophenyl)propyl]amino]-2-oxoethyl]-2-phenylacetamide
CID 41490453
N-[2-[1-(4-chlorophenyl)propylamino]-2-oxoethyl]-2-phenylacetamide
CID 17450177
3-amino-N-[1-(4-chlorophenyl)propyl]propanamide;hydrochloride
CID 119276743
2-(4-chloro-2-fluorophenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
CID 133161430
N-[(2R)-butan-2-yl]-2-(2-fluorophenyl)acetamide
CID 94102090
N-(2-amino-1-phenylethyl)-2-(2-fluorophenyl)acetamide
CID 63754506
(3S)-3-amino-N-[(1S)-1-(4-chlorophenyl)propyl]-3-phenylpropanamide
CID 124684118
N-[1-(4-chlorophenyl)propyl]-3-phenylbutanamide
CID 24613384
N-[1-(4-chlorophenyl)propyl]-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 18158666

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide (CID 18158661) is N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide is CCC(NC(=O)Cc1ccccc1F)c1ccc(Cl)cc1.
What is the InChIKey of N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide?
The InChIKey is XGTSEONYSNCWTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClFNO/c1-2-16(12-7-9-14(18)10-8-12)20-17(21)11-13-5-3-4-6-15(13)19/h3-10,16H,2,11H2,1H3,(H,20,21).
What are the key properties of N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide?
N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide has a molecular weight of 305.78 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 18158661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).