(2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide

C27H23FN2O — CID 67307773

IUPAC(2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide
SMILESCc1cc(-c2ccc(NC(=O)[C@H](C)c3ccc(-c4ccccc4)c(F)c3)cc2)ccn1
InChIInChI=1S/C27H23FN2O/c1-18-16-23(14-15-29-18)20-8-11-24(12-9-20)30-27(31)19(2)22-10-13-25(26(28)17-22)21-6-4-3-5-7-21/h3-17,19H,1-2H3,(H,30,31)/t19-/m1/s1
InChIKeyAGNDMLXIDSOOGG-LJQANCHMSA-N
MW410.49 g/mol
LogP6.61
Rot. Bonds5

About (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide

(2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide (PubChem CID 67307773) has the molecular formula C27H23FN2O and a molecular weight of 410.49 g/mol. Its IUPAC name is (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide
PubChem CID67307773
Molecular FormulaC27H23FN2O
Molecular Weight410.49 g/mol
Exact Mass410.18
IUPAC Name(2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide
SMILESCc1cc(-c2ccc(NC(=O)[C@H](C)c3ccc(-c4ccccc4)c(F)c3)cc2)ccn1
InChIInChI=1S/C27H23FN2O/c1-18-16-23(14-15-29-18)20-8-11-24(12-9-20)30-27(31)19(2)22-10-13-25(26(28)17-22)21-6-4-3-5-7-21/h3-17,19H,1-2H3,(H,30,31)/t19-/m1/s1
InChIKeyAGNDMLXIDSOOGG-LJQANCHMSA-N
XLogP6.61
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.49
LogP ≤ 56.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-[4-(2-methyl-4-pyridinyl)phenyl]-2-(4-phenylphenyl)pentanamide
CID 67309518
(2S)-N-(3,5-difluorophenyl)-2-(3-fluoro-4-phenylphenyl)propanamide
CID 985824
2-[3-(3-cyanophenyl)phenyl]-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide
CID 67309019
2-(3-fluoro-4-phenylphenyl)-N-[(4-methylphenyl)carbamothioyl]propanamide
CID 139232887
N-[4-(2-methyl-4-pyridinyl)phenyl]-2-(4-nitrophenyl)propanamide
CID 67308595
2-(6-methoxynaphthalen-2-yl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide
CID 67308427
(2R)-2-(3-fluoro-4-phenylphenyl)-N-(2-methylphenyl)propanamide
CID 850709
(2R)-2-(3-fluoro-4-phenylphenyl)-N-(1,3-thiazol-2-yl)propanamide
CID 40961510
ethane;2-[3-[6-(methylamino)-3-pyridinyl]phenyl]-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide
CID 143818025
(2R)-N-[4-(2-methyl-4-pyridinyl)phenyl]-2-[3-(4-morpholin-4-ylphenyl)phenyl]propanamide
CID 67308603
2-(3-bromo-4-fluorophenyl)-4-methyl-N-[4-(2-methyl-4-pyridinyl)phenyl]pentanamide
CID 123982115
(2R)-N-(2,5-dimethylphenyl)-2-(3-fluoro-4-phenylphenyl)propanamide
CID 850717

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide?
The IUPAC name of (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide (CID 67307773) is (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide.
What is the SMILES notation for (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide?
The canonical SMILES for (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide is Cc1cc(-c2ccc(NC(=O)[C@H](C)c3ccc(-c4ccccc4)c(F)c3)cc2)ccn1.
What is the InChIKey of (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide?
The InChIKey is AGNDMLXIDSOOGG-LJQANCHMSA-N. The full InChI is InChI=1S/C27H23FN2O/c1-18-16-23(14-15-29-18)20-8-11-24(12-9-20)30-27(31)19(2)22-10-13-25(26(28)17-22)21-6-4-3-5-7-21/h3-17,19H,1-2H3,(H,30,31)/t19-/m1/s1.
What are the key properties of (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide?
(2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide has a molecular weight of 410.49 g/mol, XLogP of 6.61, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-fluoro-4-phenylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]propanamide is sourced from PubChem (CID 67307773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).