N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide

C21H16FNO2 — CID 100553789

IUPACN-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide
SMILESO=C(CCc1ccccc1F)Nc1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C21H16FNO2/c22-18-7-3-1-5-14(18)9-12-21(24)23-15-10-11-17-16-6-2-4-8-19(16)25-20(17)13-15/h1-8,10-11,13H,9,12H2,(H,23,24)
InChIKeyUPQIIUGYKAMQBH-UHFFFAOYSA-N
MW333.36 g/mol
LogP5.30
Rot. Bonds4

About N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide

N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide (PubChem CID 100553789) has the molecular formula C21H16FNO2 and a molecular weight of 333.36 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide
PubChem CID100553789
Molecular FormulaC21H16FNO2
Molecular Weight333.36 g/mol
Exact Mass333.12
IUPAC NameN-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide
SMILESO=C(CCc1ccccc1F)Nc1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C21H16FNO2/c22-18-7-3-1-5-14(18)9-12-21(24)23-15-10-11-17-16-6-2-4-8-19(16)25-20(17)13-15/h1-8,10-11,13H,9,12H2,(H,23,24)
InChIKeyUPQIIUGYKAMQBH-UHFFFAOYSA-N
XLogP5.30
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.36
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-fluorophenyl)-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)propanamide
CID 110607968
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CID 2972003
3-(2-fluorophenyl)-N-quinoxalin-6-ylpropanamide
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N-dibenzofuran-3-yl-N'-dibenzothiophen-3-ylpentanediamide
CID 71761280
3-(2-fluorophenyl)-N-[4-(trifluoromethyl)phenyl]propanamide
CID 26716432
1-dibenzofuran-3-yl-3-[3-(dibenzofuran-3-ylcarbamoylamino)phenyl]urea
CID 4639027
3-(2-fluorophenyl)-N-(1-methyl-6-oxo-3-pyridinyl)propanamide
CID 47067445
N-dibenzofuran-3-yl-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 2961461
N-dibenzofuran-3-yl-N'-(6,8-diiododibenzofuran-3-yl)pentanediamide
CID 71761184
N-[4-[3-(2-fluorophenyl)propanoylamino]phenyl]cyclopropanecarboxamide
CID 41266031
N-[4-[[(2-cyanoacetyl)amino]methyl]phenyl]-3-(2-fluorophenyl)propanamide
CID 108923344
3-(2-fluorophenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 38196539

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide?
The IUPAC name of N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide (CID 100553789) is N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide.
What is the SMILES notation for N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide?
The canonical SMILES for N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide is O=C(CCc1ccccc1F)Nc1ccc2c(c1)oc1ccccc12.
What is the InChIKey of N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide?
The InChIKey is UPQIIUGYKAMQBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FNO2/c22-18-7-3-1-5-14(18)9-12-21(24)23-15-10-11-17-16-6-2-4-8-19(16)25-20(17)13-15/h1-8,10-11,13H,9,12H2,(H,23,24).
What are the key properties of N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide?
N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide has a molecular weight of 333.36 g/mol, XLogP of 5.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-3-(2-fluorophenyl)propanamide is sourced from PubChem (CID 100553789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).