N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine

C19H14FNO — CID 2966855

IUPACN-[(4-fluorophenyl)methyl]dibenzofuran-3-amine
SMILESFc1ccc(CNc2ccc3c(c2)oc2ccccc23)cc1
InChIInChI=1S/C19H14FNO/c20-14-7-5-13(6-8-14)12-21-15-9-10-17-16-3-1-2-4-18(16)22-19(17)11-15/h1-11,21H,12H2
InChIKeyPKOQGYZFMOEAKJ-UHFFFAOYSA-N
MW291.33 g/mol
LogP5.34
Rot. Bonds3

About N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine

N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine (PubChem CID 2966855) has the molecular formula C19H14FNO and a molecular weight of 291.33 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]dibenzofuran-3-amine
PubChem CID2966855
Molecular FormulaC19H14FNO
Molecular Weight291.33 g/mol
Exact Mass291.11
IUPAC NameN-[(4-fluorophenyl)methyl]dibenzofuran-3-amine
SMILESFc1ccc(CNc2ccc3c(c2)oc2ccccc23)cc1
InChIInChI=1S/C19H14FNO/c20-14-7-5-13(6-8-14)12-21-15-9-10-17-16-3-1-2-4-18(16)22-19(17)11-15/h1-11,21H,12H2
InChIKeyPKOQGYZFMOEAKJ-UHFFFAOYSA-N
XLogP5.34
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500291.33
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine?
The IUPAC name of N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine (CID 2966855) is N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine?
The canonical SMILES for N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine is Fc1ccc(CNc2ccc3c(c2)oc2ccccc23)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine?
The InChIKey is PKOQGYZFMOEAKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FNO/c20-14-7-5-13(6-8-14)12-21-15-9-10-17-16-3-1-2-4-18(16)22-19(17)11-15/h1-11,21H,12H2.
What are the key properties of N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine?
N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine has a molecular weight of 291.33 g/mol, XLogP of 5.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]dibenzofuran-3-amine is sourced from PubChem (CID 2966855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).