(3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide

C16H16F2N2O3S — CID 100783017

IUPAC(3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide
SMILESCS(=O)(=O)N[C@H](CC(=O)Nc1ccccc1F)c1ccc(F)cc1
InChIInChI=1S/C16H16F2N2O3S/c1-24(22,23)20-15(11-6-8-12(17)9-7-11)10-16(21)19-14-5-3-2-4-13(14)18/h2-9,15,20H,10H2,1H3,(H,19,21)/t15-/m1/s1
InChIKeyQULUCHZPJWXIKP-OAHLLOKOSA-N
MW354.38 g/mol
LogP2.58
Rot. Bonds6

About (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide

(3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide (PubChem CID 100783017) has the molecular formula C16H16F2N2O3S and a molecular weight of 354.38 g/mol. Its IUPAC name is (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide.

Molecular Properties

Compound Name(3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide
PubChem CID100783017
Molecular FormulaC16H16F2N2O3S
Molecular Weight354.38 g/mol
Exact Mass354.08
IUPAC Name(3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide
SMILESCS(=O)(=O)N[C@H](CC(=O)Nc1ccccc1F)c1ccc(F)cc1
InChIInChI=1S/C16H16F2N2O3S/c1-24(22,23)20-15(11-6-8-12(17)9-7-11)10-16(21)19-14-5-3-2-4-13(14)18/h2-9,15,20H,10H2,1H3,(H,19,21)/t15-/m1/s1
InChIKeyQULUCHZPJWXIKP-OAHLLOKOSA-N
XLogP2.58
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-fluorophenyl)-3-(methanesulfonamido)-N-(2-phenylsulfanylphenyl)propanamide
CID 133255202
(3S)-3-(4-fluorophenyl)-3-(methanesulfonamido)-N-(2-phenylsulfanylphenyl)propanamide
CID 100783284
(3S)-N-(2-chlorophenyl)-3-(4-chlorophenyl)-3-(methanesulfonamido)propanamide
CID 100783701
3-(4-chlorophenyl)-3-(methanesulfonamido)-N-(2-methylphenyl)propanamide
CID 133255260
(3S)-3-(4-fluorophenyl)-3-(methanesulfonamido)-N-(4-propan-2-ylphenyl)propanamide
CID 100783011
3-(4-fluorophenyl)-3-(methanesulfonamido)-N-(4-phenoxyphenyl)propanamide
CID 133255173
(3S)-N-ethyl-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide
CID 100782888
(3R)-N-(4-ethylphenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide
CID 100783006
3-(4-fluorophenyl)-3-(methanesulfonamido)-N-(2,4,6-trimethylphenyl)propanamide
CID 133255204
N-(3-bromophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide
CID 133255156
(3R)-N-(4-fluorophenyl)-3-(methanesulfonamido)-3-(4-methoxyphenyl)propanamide
CID 100784349
N-(3,4-dichlorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide
CID 133255165

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide?
The IUPAC name of (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide (CID 100783017) is (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide.
What is the SMILES notation for (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide?
The canonical SMILES for (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide is CS(=O)(=O)N[C@H](CC(=O)Nc1ccccc1F)c1ccc(F)cc1.
What is the InChIKey of (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide?
The InChIKey is QULUCHZPJWXIKP-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H16F2N2O3S/c1-24(22,23)20-15(11-6-8-12(17)9-7-11)10-16(21)19-14-5-3-2-4-13(14)18/h2-9,15,20H,10H2,1H3,(H,19,21)/t15-/m1/s1.
What are the key properties of (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide?
(3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide has a molecular weight of 354.38 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2-fluorophenyl)-3-(4-fluorophenyl)-3-(methanesulfonamido)propanamide is sourced from PubChem (CID 100783017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).