N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide

C19H15ClFNOS — CID 95153027

IUPACN-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)N[C@H](c1ccc(Cl)cc1)c1ccsc1
InChIInChI=1S/C19H15ClFNOS/c20-16-7-5-13(6-8-16)19(15-9-10-24-12-15)22-18(23)11-14-3-1-2-4-17(14)21/h1-10,12,19H,11H2,(H,22,23)/t19-/m1/s1
InChIKeyJICOFHUBFOZJEF-LJQANCHMSA-N
MW359.85 g/mol
LogP4.99
Rot. Bonds5

About N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide

N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide (PubChem CID 95153027) has the molecular formula C19H15ClFNOS and a molecular weight of 359.85 g/mol. Its IUPAC name is N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide
PubChem CID95153027
Molecular FormulaC19H15ClFNOS
Molecular Weight359.85 g/mol
Exact Mass359.05
IUPAC NameN-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)N[C@H](c1ccc(Cl)cc1)c1ccsc1
InChIInChI=1S/C19H15ClFNOS/c20-16-7-5-13(6-8-16)19(15-9-10-24-12-15)22-18(23)11-14-3-1-2-4-17(14)21/h1-10,12,19H,11H2,(H,22,23)/t19-/m1/s1
InChIKeyJICOFHUBFOZJEF-LJQANCHMSA-N
XLogP4.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.85
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 7733439
2-(2-fluorophenyl)-N-(2-hydroxy-2-thiophen-3-ylethyl)acetamide
CID 103686234
N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide
CID 18158661
2-(2-fluorophenyl)-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
CID 8854118
2-acetamido-N-[(4-chlorophenyl)-thiophen-3-ylmethyl]propanamide
CID 86840905
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-(2-fluorophenyl)acetamide
CID 32631324
N-[(4-chlorophenyl)-thiophen-3-ylmethyl]-N'-(2-cyanoethyl)-N'-phenylbutanediamide
CID 56506370
2-(2-chlorophenyl)-N-[(4-fluorophenyl)-phenylmethyl]acetamide
CID 55583548
N-[(S)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-[(2R)-oxolan-2-yl]acetamide
CID 94663590
N-[(1S)-1-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 8700805
2-chloro-N-[(S)-(4-chlorophenyl)-phenylmethyl]acetamide
CID 2466705
N-[(4-chlorophenyl)-thiophen-3-ylmethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 60579990

Frequently Asked Questions

What is the IUPAC name of N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide (CID 95153027) is N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide is O=C(Cc1ccccc1F)N[C@H](c1ccc(Cl)cc1)c1ccsc1.
What is the InChIKey of N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide?
The InChIKey is JICOFHUBFOZJEF-LJQANCHMSA-N. The full InChI is InChI=1S/C19H15ClFNOS/c20-16-7-5-13(6-8-16)19(15-9-10-24-12-15)22-18(23)11-14-3-1-2-4-17(14)21/h1-10,12,19H,11H2,(H,22,23)/t19-/m1/s1.
What are the key properties of N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide?
N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide has a molecular weight of 359.85 g/mol, XLogP of 4.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-(4-chlorophenyl)-thiophen-3-ylmethyl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 95153027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).