N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide

C20H24FN3O2 — CID 9133555

IUPACN-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1
InChIInChI=1S/C20H24FN3O2/c1-13(2)20(15-4-6-16(21)7-5-15)22-12-19(26)24-18-10-8-17(9-11-18)23-14(3)25/h4-11,13,20,22H,12H2,1-3H3,(H,23,25)(H,24,26)/t20-/m1/s1
InChIKeyHVLKBVLQGMKOFH-HXUWFJFHSA-N
MW357.43 g/mol
LogP3.71
Rot. Bonds7

About N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide

N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide (PubChem CID 9133555) has the molecular formula C20H24FN3O2 and a molecular weight of 357.43 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide
PubChem CID9133555
Molecular FormulaC20H24FN3O2
Molecular Weight357.43 g/mol
Exact Mass357.19
IUPAC NameN-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1
InChIInChI=1S/C20H24FN3O2/c1-13(2)20(15-4-6-16(21)7-5-15)22-12-19(26)24-18-10-8-17(9-11-18)23-14(3)25/h4-11,13,20,22H,12H2,1-3H3,(H,23,25)(H,24,26)/t20-/m1/s1
InChIKeyHVLKBVLQGMKOFH-HXUWFJFHSA-N
XLogP3.71
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 53.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131833
N-[4-(difluoromethylsulfanyl)phenyl]-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide
CID 39991641
N-(4-acetamidophenyl)-2-[[(1R)-2-methyl-1-[4-(2-methylpropyl)phenyl]propyl]amino]acetamide
CID 8995951
2-[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]-N-(3-methylphenyl)acetamide
CID 9133292
2-[[(2S)-butan-2-yl]amino]-N-(4-fluorophenyl)acetamide
CID 28565900
N-(3-acetamidophenyl)-2-[(2-methyl-1-phenylpropyl)amino]acetamide
CID 86909136
N-(2,6-diethylphenyl)-2-[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide
CID 9133410
N-(2,6-diethylphenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide
CID 9133408
2-[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 94471434
N-[2-(ethylamino)-2-oxoethyl]-2-[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide
CID 9134101
N-(4-fluorophenyl)-2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]acetamide
CID 79250136
N-(4-fluorophenyl)-2-(1-methoxypropan-2-ylamino)acetamide
CID 43179600

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide (CID 9133555) is N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide is CC(=O)Nc1ccc(NC(=O)CN[C@@H](c2ccc(F)cc2)C(C)C)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide?
The InChIKey is HVLKBVLQGMKOFH-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H24FN3O2/c1-13(2)20(15-4-6-16(21)7-5-15)22-12-19(26)24-18-10-8-17(9-11-18)23-14(3)25/h4-11,13,20,22H,12H2,1-3H3,(H,23,25)(H,24,26)/t20-/m1/s1.
What are the key properties of N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide?
N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide has a molecular weight of 357.43 g/mol, XLogP of 3.71, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[[(1R)-1-(4-fluorophenyl)-2-methylpropyl]amino]acetamide is sourced from PubChem (CID 9133555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).