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

C18H15NO — CID 14064974

IUPAC1-phenyl-3H-benzo[g][2]benzofuran-1-amine
SMILESNC1(c2ccccc2)OCc2ccc3ccccc3c21
InChIInChI=1S/C18H15NO/c19-18(15-7-2-1-3-8-15)17-14(12-20-18)11-10-13-6-4-5-9-16(13)17/h1-11H,12,19H2
InChIKeyXANDIYDODHNAIL-UHFFFAOYSA-N
MW261.32 g/mol
LogP3.53
Rot. Bonds1

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

1-phenyl-3H-benzo[g][2]benzofuran-1-amine (PubChem CID 14064974) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-phenyl-3H-benzo[g][2]benzofuran-1-amine.

Molecular Properties

Compound Name1-phenyl-3H-benzo[g][2]benzofuran-1-amine
PubChem CID14064974
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name1-phenyl-3H-benzo[g][2]benzofuran-1-amine
SMILESNC1(c2ccccc2)OCc2ccc3ccccc3c21
InChIInChI=1S/C18H15NO/c19-18(15-7-2-1-3-8-15)17-14(12-20-18)11-10-13-6-4-5-9-16(13)17/h1-11H,12,19H2
InChIKeyXANDIYDODHNAIL-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-Phenyl-1,3-dihydronaphtho[2,3-c]furan-1-amine
CID 14064964
1-[4-(1-amino-3-phenyl-3H-2-benzofuran-1-yl)phenyl]-3-phenyl-3H-2-benzofuran-1-amine
CID 101479607

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3H-benzo[g][2]benzofuran-1-amine?
The IUPAC name of 1-phenyl-3H-benzo[g][2]benzofuran-1-amine (CID 14064974) is 1-phenyl-3H-benzo[g][2]benzofuran-1-amine.
What is the SMILES notation for 1-phenyl-3H-benzo[g][2]benzofuran-1-amine?
The canonical SMILES for 1-phenyl-3H-benzo[g][2]benzofuran-1-amine is NC1(c2ccccc2)OCc2ccc3ccccc3c21.
What is the InChIKey of 1-phenyl-3H-benzo[g][2]benzofuran-1-amine?
The InChIKey is XANDIYDODHNAIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO/c19-18(15-7-2-1-3-8-15)17-14(12-20-18)11-10-13-6-4-5-9-16(13)17/h1-11H,12,19H2.
What are the key properties of 1-phenyl-3H-benzo[g][2]benzofuran-1-amine?
1-phenyl-3H-benzo[g][2]benzofuran-1-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 1-phenyl-3H-benzo[g][2]benzofuran-1-amine is sourced from PubChem (CID 14064974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).