N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine

C28H19NO — CID 126550567

IUPACN,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine
SMILESc1ccc(Nc2c3ccccc3cc3c2oc2ccc(-c4ccccc4)cc23)cc1
InChIInChI=1S/C28H19NO/c1-3-9-19(10-4-1)20-15-16-26-24(17-20)25-18-21-11-7-8-14-23(21)27(28(25)30-26)29-22-12-5-2-6-13-22/h1-18,29H
InChIKeyVXKMRKUDBJXARK-UHFFFAOYSA-N
MW385.47 g/mol
LogP8.15
Rot. Bonds3

About N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine

N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine (PubChem CID 126550567) has the molecular formula C28H19NO and a molecular weight of 385.47 g/mol. Its IUPAC name is N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine.

Molecular Properties

Compound NameN,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine
PubChem CID126550567
Molecular FormulaC28H19NO
Molecular Weight385.47 g/mol
Exact Mass385.15
IUPAC NameN,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine
SMILESc1ccc(Nc2c3ccccc3cc3c2oc2ccc(-c4ccccc4)cc23)cc1
InChIInChI=1S/C28H19NO/c1-3-9-19(10-4-1)20-15-16-26-24(17-20)25-18-21-11-7-8-14-23(21)27(28(25)30-26)29-22-12-5-2-6-13-22/h1-18,29H
InChIKeyVXKMRKUDBJXARK-UHFFFAOYSA-N
XLogP8.15
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.47
LogP ≤ 58.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4,8-diphenyldibenzofuran-2-yl)-N-phenylaniline
CID 164934450
2-[4-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran
CID 90433351
2-naphthalen-2-yl-4-phenyl-6-[6-(3-phenylphenyl)naphtho[2,3-b][1]benzofuran-2-yl]-1,3,5-triazine
CID 170211717
N-[4-(6-phenanthren-9-yldibenzofuran-2-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 130208153
2,8-bis(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran;2,8-bis(6-phenylnaphthalen-2-yl)dibenzofuran;2,8-bis(7-phenylnaphthalen-2-yl)dibenzofuran;2-[7-(cyclodecapentaenyl)naphthalen-2-yl]-8-(7-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran
CID 158865776
CID 174363162
CID 174363162
2-(6-phenanthren-9-ylnaphthalen-2-yl)-8-phenyldibenzofuran
CID 58569217
2-[3-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran
CID 90433458
N-(4-naphtho[1,2-b][1]benzofuran-8-ylphenyl)-4-phenylaniline;N-(4-naphtho[2,1-b][1]benzofuran-9-ylphenyl)-3-(4-phenylphenyl)aniline;N-[4-(3-naphtho[2,3-b][1]benzofuran-4-ylphenyl)phenyl]-4-phenylaniline
CID 158669625
17-phenyl-21-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene
CID 146440204
5-phenyl-16-(5-phenyl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaen-16-yl)-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaene
CID 58004094
5,16-bis(8-phenyldibenzofuran-2-yl)-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaene;5-phenyl-16-(5-phenyl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaen-16-yl)-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaene;16-phenyl-5-(16-phenyl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaen-5-yl)-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaene;5-phenyl-16-[4-(5-phenyl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaen-16-yl)phenyl]-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaene;16-phenyl-5-[4-(16-phenyl-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaen-5-yl)phenyl]-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3(8),4,6,11,14(19),15,17-nonaene
CID 161042353

Frequently Asked Questions

What is the IUPAC name of N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine?
The IUPAC name of N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine (CID 126550567) is N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine.
What is the SMILES notation for N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine?
The canonical SMILES for N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine is c1ccc(Nc2c3ccccc3cc3c2oc2ccc(-c4ccccc4)cc23)cc1.
What is the InChIKey of N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine?
The InChIKey is VXKMRKUDBJXARK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H19NO/c1-3-9-19(10-4-1)20-15-16-26-24(17-20)25-18-21-11-7-8-14-23(21)27(28(25)30-26)29-22-12-5-2-6-13-22/h1-18,29H.
What are the key properties of N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine?
N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine has a molecular weight of 385.47 g/mol, XLogP of 8.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diphenylnaphtho[2,3-b][1]benzofuran-6-amine is sourced from PubChem (CID 126550567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).