(2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide

C22H20F2N2O — CID 9445859

IUPAC(2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide
SMILESC[C@@H](NC(c1ccccc1)c1ccccc1)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C22H20F2N2O/c1-15(22(27)26-21-18(23)13-8-14-19(21)24)25-20(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-15,20,25H,1H3,(H,26,27)/t15-/m1/s1
InChIKeyFJJQAUGWCJQCRZ-OAHLLOKOSA-N
MW366.41 g/mol
LogP4.67
Rot. Bonds6

About (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide

(2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide (PubChem CID 9445859) has the molecular formula C22H20F2N2O and a molecular weight of 366.41 g/mol. Its IUPAC name is (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide
PubChem CID9445859
Molecular FormulaC22H20F2N2O
Molecular Weight366.41 g/mol
Exact Mass366.15
IUPAC Name(2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide
SMILESC[C@@H](NC(c1ccccc1)c1ccccc1)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C22H20F2N2O/c1-15(22(27)26-21-18(23)13-8-14-19(21)24)25-20(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-15,20,25H,1H3,(H,26,27)/t15-/m1/s1
InChIKeyFJJQAUGWCJQCRZ-OAHLLOKOSA-N
XLogP4.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(benzhydrylamino)-N-(3-fluorophenyl)propanamide
CID 9445795
2-[1-(3-chlorophenyl)ethylamino]-N-(2,6-difluorophenyl)propanamide
CID 46667108
N-(2,6-difluorophenyl)-2-methoxy-2-phenylacetamide
CID 2955946
N-(2,6-difluorophenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392689
2-(benzhydrylamino)-N-(3-chloro-2-methylphenyl)propanamide
CID 55430532
2-amino-N-(2,6-difluorophenyl)propanamide
CID 43087644
(2S)-N-(4-acetylphenyl)-2-(benzhydrylamino)propanamide
CID 7516109
2-(benzhydrylamino)-N-carbamoylpropanamide
CID 42915569
4-[[(2R)-2-(benzhydrylamino)propanoyl]amino]benzamide
CID 7971112
(2R)-2-(benzhydrylamino)-N-(3-methoxyphenyl)propanamide
CID 8545508
(2S)-2-(benzhydrylamino)-N-cyclopropylpropanamide
CID 7614348
(2R)-2-[(2,6-difluorophenyl)carbamoylamino]propanoic acid
CID 54991149

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide?
The IUPAC name of (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide (CID 9445859) is (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide.
What is the SMILES notation for (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide?
The canonical SMILES for (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide is C[C@@H](NC(c1ccccc1)c1ccccc1)C(=O)Nc1c(F)cccc1F.
What is the InChIKey of (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide?
The InChIKey is FJJQAUGWCJQCRZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H20F2N2O/c1-15(22(27)26-21-18(23)13-8-14-19(21)24)25-20(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-15,20,25H,1H3,(H,26,27)/t15-/m1/s1.
What are the key properties of (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide?
(2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide has a molecular weight of 366.41 g/mol, XLogP of 4.67, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(benzhydrylamino)-N-(2,6-difluorophenyl)propanamide is sourced from PubChem (CID 9445859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).