3-phenyl-1H-benzo[f][2]benzofuran-3-amine

C18H15NO — CID 14064964

IUPAC3-phenyl-1H-benzo[f][2]benzofuran-3-amine
SMILESNC1(c2ccccc2)OCc2cc3ccccc3cc21
InChIInChI=1S/C18H15NO/c19-18(16-8-2-1-3-9-16)17-11-14-7-5-4-6-13(14)10-15(17)12-20-18/h1-11H,12,19H2
InChIKeyBRSBBBGJEMMYID-UHFFFAOYSA-N
MW261.32 g/mol
LogP3.53
Rot. Bonds1

About 3-phenyl-1H-benzo[f][2]benzofuran-3-amine

3-phenyl-1H-benzo[f][2]benzofuran-3-amine (PubChem CID 14064964) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-phenyl-1H-benzo[f][2]benzofuran-3-amine.

Molecular Properties

Compound Name3-phenyl-1H-benzo[f][2]benzofuran-3-amine
PubChem CID14064964
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name3-phenyl-1H-benzo[f][2]benzofuran-3-amine
SMILESNC1(c2ccccc2)OCc2cc3ccccc3cc21
InChIInChI=1S/C18H15NO/c19-18(16-8-2-1-3-9-16)17-11-14-7-5-4-6-13(14)10-15(17)12-20-18/h1-11H,12,19H2
InChIKeyBRSBBBGJEMMYID-UHFFFAOYSA-N
XLogP3.53
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

alpha-(Trifluoromethyl)-alpha-methoxynaphthalene-2-methanamine
CID 58611148
1-phenyl-3H-2-benzofuran-1-amine
CID 14064960
4-Phenyl-1,3-dihydronaphtho[2,3-c]furan
CID 15555108
1,3-Dihydroanthra[2,3-c]furan
CID 20823213
alpha-(Trifluoromethyl)-alpha-methoxyphenanthrene-9-methanamine
CID 58611151
1-[4-(1-amino-3H-2-benzofuran-1-yl)phenyl]-3H-2-benzofuran-1-amine
CID 15258868
4-Phenyl-1,3-dihydrobenzo[e][2]benzofuran
CID 86077957
8,10-Dihydronaphtho[1,2-f][2]benzofuran
CID 102385197
2-[Azido(phenylmethoxy)methyl]naphthalene
CID 102513319
4-(Diethyl-aminomethyl)-1,3-dihydrophenanthro[1,2-c]furan
CID 134158474
1-[4-(1-amino-3-phenyl-3H-2-benzofuran-1-yl)phenyl]-3-phenyl-3H-2-benzofuran-1-amine
CID 101479607
1,3-Dihydronaphtho[2,3-e][2]benzofuran
CID 20823231

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1H-benzo[f][2]benzofuran-3-amine?
The IUPAC name of 3-phenyl-1H-benzo[f][2]benzofuran-3-amine (CID 14064964) is 3-phenyl-1H-benzo[f][2]benzofuran-3-amine.
What is the SMILES notation for 3-phenyl-1H-benzo[f][2]benzofuran-3-amine?
The canonical SMILES for 3-phenyl-1H-benzo[f][2]benzofuran-3-amine is NC1(c2ccccc2)OCc2cc3ccccc3cc21.
What is the InChIKey of 3-phenyl-1H-benzo[f][2]benzofuran-3-amine?
The InChIKey is BRSBBBGJEMMYID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO/c19-18(16-8-2-1-3-9-16)17-11-14-7-5-4-6-13(14)10-15(17)12-20-18/h1-11H,12,19H2.
What are the key properties of 3-phenyl-1H-benzo[f][2]benzofuran-3-amine?
3-phenyl-1H-benzo[f][2]benzofuran-3-amine has a molecular weight of 261.32 g/mol, XLogP of 3.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1H-benzo[f][2]benzofuran-3-amine is sourced from PubChem (CID 14064964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).