ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine

C20H21NO — CID 145105452

IUPACethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine
SMILESC1=Cc2oc3c(Nc4ccccc4)cccc3c2CC1.CC
InChIInChI=1S/C18H15NO.C2H6/c1-2-7-13(8-3-1)19-16-11-6-10-15-14-9-4-5-12-17(14)20-18(15)16;1-2/h1-3,5-8,10-12,19H,4,9H2;1-2H3
InChIKeyYWBVSLAGXSPRJF-UHFFFAOYSA-N
MW291.39 g/mol
LogP6.16
Rot. Bonds2

About ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine

ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine (PubChem CID 145105452) has the molecular formula C20H21NO and a molecular weight of 291.39 g/mol. Its IUPAC name is ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine.

Molecular Properties

Compound Nameethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine
PubChem CID145105452
Molecular FormulaC20H21NO
Molecular Weight291.39 g/mol
Exact Mass291.16
IUPAC Nameethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine
SMILESC1=Cc2oc3c(Nc4ccccc4)cccc3c2CC1.CC
InChIInChI=1S/C18H15NO.C2H6/c1-2-7-13(8-3-1)19-16-11-6-10-15-14-9-4-5-12-17(14)20-18(15)16;1-2/h1-3,5-8,10-12,19H,4,9H2;1-2H3
InChIKeyYWBVSLAGXSPRJF-UHFFFAOYSA-N
XLogP6.16
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500291.39
LogP ≤ 56.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-bromo-1,2-dihydrodibenzofuran
CID 121420689
8,9-dihydrodibenzofuran-4-ylboronic acid
CID 123567559
6-(10-phenylanthracen-9-yl)-1,2-dihydrodibenzofuran
CID 87631578
6-(10-pyren-1-ylanthracen-9-yl)-1,2-dihydrodibenzofuran
CID 88564296
9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol
CID 163459929
2-[3-(8,9-dihydrodibenzofuran-4-yl)phenyl]-3-(2,4,6-trimethylphenyl)phenanthro[9,10-b]pyrazine
CID 88905815
N-[4-[4-(dibenzofuran-4-ylamino)phenyl]phenyl]dibenzofuran-4-amine
CID 172539034
4-[4-[8-[4-(8,9-dihydrodibenzofuran-4-yl)phenyl]pyren-1-yl]phenyl]dibenzofuran
CID 88912607
2-chloro-4-[3-(7,8-dihydronaphtho[1,2-b][1]benzofuran-5-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 174310954
4-amino-8,9-dihydrodibenzofuran-3-carbonitrile
CID 163438436
N-phenyl-1,2-dihydrodibenzofuran-3-amine
CID 174387445
6-(2-methylpropyl)-N-phenylnaphtho[2,1-b][1]benzofuran-8-amine
CID 146579665

Frequently Asked Questions

What is the IUPAC name of ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine?
The IUPAC name of ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine (CID 145105452) is ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine.
What is the SMILES notation for ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine?
The canonical SMILES for ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine is C1=Cc2oc3c(Nc4ccccc4)cccc3c2CC1.CC.
What is the InChIKey of ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine?
The InChIKey is YWBVSLAGXSPRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO.C2H6/c1-2-7-13(8-3-1)19-16-11-6-10-15-14-9-4-5-12-17(14)20-18(15)16;1-2/h1-3,5-8,10-12,19H,4,9H2;1-2H3.
What are the key properties of ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine?
ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine has a molecular weight of 291.39 g/mol, XLogP of 6.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine is sourced from PubChem (CID 145105452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).