11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole

C25H17NO — CID 169027972

IUPAC11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole
SMILESCn1c2ccccc2c2c(-c3ccccc3)c3oc4ccccc4c3cc21
InChIInChI=1S/C25H17NO/c1-26-20-13-7-5-12-18(20)24-21(26)15-19-17-11-6-8-14-22(17)27-25(19)23(24)16-9-3-2-4-10-16/h2-15H,1H3
InChIKeyKEGNXMMEESXRCQ-UHFFFAOYSA-N
MW347.42 g/mol
LogP6.90
Rot. Bonds1

About 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole

11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole (PubChem CID 169027972) has the molecular formula C25H17NO and a molecular weight of 347.42 g/mol. Its IUPAC name is 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole.

Molecular Properties

Compound Name11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole
PubChem CID169027972
Molecular FormulaC25H17NO
Molecular Weight347.42 g/mol
Exact Mass347.13
IUPAC Name11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole
SMILESCn1c2ccccc2c2c(-c3ccccc3)c3oc4ccccc4c3cc21
InChIInChI=1S/C25H17NO/c1-26-20-13-7-5-12-18(20)24-21(26)15-19-17-11-6-8-14-22(17)27-25(19)23(24)16-9-3-2-4-10-16/h2-15H,1H3
InChIKeyKEGNXMMEESXRCQ-UHFFFAOYSA-N
XLogP6.90
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.42
LogP ≤ 56.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(7-methyl-[1]benzofuro[2,3-b]carbazol-6-yl)phenol
CID 155680737
10-methyl-14,21-diphenyl-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene
CID 58131761
3,25-diphenyl-14,36-dioxa-5,27-diazatridecacyclo[25.17.1.15,12.02,26.04,24.06,11.013,21.015,20.028,33.034,45.035,43.037,42.023,46]hexatetraconta-1(45),2,4(24),6,8,10,12,15,17,19,21,23(46),25,28,30,32,34,37,39,41,43-henicosaene
CID 146512323
11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole
CID 169027784
3-dibenzofuran-2-yl-9-methylcarbazole
CID 121307339
12-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 88568798
1,2-dimethyl-3-phenyl-[1]benzofuro[3,2-b]pyrrole
CID 157483251
9-methyl-3-[11-(4-naphthalen-2-ylphenyl)naphtho[2,3-b][1]benzofuran-6-yl]carbazole
CID 176777807
9-methyl-3-[6-(4-naphthalen-2-ylphenyl)naphtho[3,2-b][1]benzofuran-11-yl]carbazole
CID 176777757
14-[4-(10-phenylanthracen-9-yl)phenyl]-12,16-dioxahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 130190122
10,14-dimethyl-2-phenyl-10,12,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 12780582
11-methyl-5,6-diphenylbenzo[a]carbazole
CID 102308000

Frequently Asked Questions

What is the IUPAC name of 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole?
The IUPAC name of 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole (CID 169027972) is 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole.
What is the SMILES notation for 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole?
The canonical SMILES for 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole is Cn1c2ccccc2c2c(-c3ccccc3)c3oc4ccccc4c3cc21.
What is the InChIKey of 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole?
The InChIKey is KEGNXMMEESXRCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO/c1-26-20-13-7-5-12-18(20)24-21(26)15-19-17-11-6-8-14-22(17)27-25(19)23(24)16-9-3-2-4-10-16/h2-15H,1H3.
What are the key properties of 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole?
11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole has a molecular weight of 347.42 g/mol, XLogP of 6.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-6-phenyl-[1]benzofuro[3,2-b]carbazole is sourced from PubChem (CID 169027972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).