N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide

C16H17FN2O — CID 105060348

IUPACN-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide
SMILESCC(CN)(NC(=O)c1ccccc1F)c1ccccc1
InChIInChI=1S/C16H17FN2O/c1-16(11-18,12-7-3-2-4-8-12)19-15(20)13-9-5-6-10-14(13)17/h2-10H,11,18H2,1H3,(H,19,20)
InChIKeyQISFKPPNOIDIDX-UHFFFAOYSA-N
MW272.32 g/mol
LogP2.43
Rot. Bonds4

About N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide

N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide (PubChem CID 105060348) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide
PubChem CID105060348
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC NameN-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide
SMILESCC(CN)(NC(=O)c1ccccc1F)c1ccccc1
InChIInChI=1S/C16H17FN2O/c1-16(11-18,12-7-3-2-4-8-12)19-15(20)13-9-5-6-10-14(13)17/h2-10H,11,18H2,1H3,(H,19,20)
InChIKeyQISFKPPNOIDIDX-UHFFFAOYSA-N
XLogP2.43
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-2-phenylpropan-2-yl)-4-fluoro-3-methylbenzamide
CID 105060363
N-(1-amino-2-phenylpropan-2-yl)-1,3-dimethylpyrazole-4-carboxamide
CID 102802495
N-(1-amino-2-phenylpropan-2-yl)-2-methylfuran-3-carboxamide
CID 105060475
N-(1-amino-2-phenylpropan-2-yl)-3-fluorobenzamide
CID 105060344
N-(1-amino-2-phenylpropan-2-yl)-4-methylbenzamide
CID 105060436
N-(1-amino-2-phenylpropan-2-yl)-3,3,3-trifluoropropanamide
CID 105060471
2-fluoro-N-(2,4,4-trimethylpentan-2-yl)benzamide
CID 1241760
2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide
CID 105058990
4-bromo-N-(1-bromo-2-phenylpropan-2-yl)-2-fluorobenzamide
CID 105060193
N-(1-chloro-2-phenylpropan-2-yl)-2,6-difluorobenzamide
CID 105059916
2-methoxy-N-(2-phenylbutan-2-yl)benzamide
CID 86899366
N-(1-chloro-2-methylbutan-2-yl)-2-fluorobenzamide
CID 114303803

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide?
The IUPAC name of N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide (CID 105060348) is N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide.
What is the SMILES notation for N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide?
The canonical SMILES for N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide is CC(CN)(NC(=O)c1ccccc1F)c1ccccc1.
What is the InChIKey of N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide?
The InChIKey is QISFKPPNOIDIDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c1-16(11-18,12-7-3-2-4-8-12)19-15(20)13-9-5-6-10-14(13)17/h2-10H,11,18H2,1H3,(H,19,20).
What are the key properties of N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide?
N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide has a molecular weight of 272.32 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide is sourced from PubChem (CID 105060348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).