9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran

C23H16O2 — CID 155128175

IUPAC9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran
SMILESCOc1ccc2c(c1)oc1c(-c3ccccc3)cc3ccccc3c12
InChIInChI=1S/C23H16O2/c1-24-17-11-12-19-21(14-17)25-23-20(15-7-3-2-4-8-15)13-16-9-5-6-10-18(16)22(19)23/h2-14H,1H3
InChIKeyYNMOJPIUFMPTCA-UHFFFAOYSA-N
MW324.38 g/mol
LogP6.41
Rot. Bonds2

About 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran

9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran (PubChem CID 155128175) has the molecular formula C23H16O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran.

Molecular Properties

Compound Name9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran
PubChem CID155128175
Molecular FormulaC23H16O2
Molecular Weight324.38 g/mol
Exact Mass324.12
IUPAC Name9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran
SMILESCOc1ccc2c(c1)oc1c(-c3ccccc3)cc3ccccc3c12
InChIInChI=1S/C23H16O2/c1-24-17-11-12-19-21(14-17)25-23-20(15-7-3-2-4-8-15)13-16-9-5-6-10-18(16)22(19)23/h2-14H,1H3
InChIKeyYNMOJPIUFMPTCA-UHFFFAOYSA-N
XLogP6.41
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.38
LogP ≤ 56.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N,6-triphenylnaphtho[2,1-b][1]benzofuran-9-amine
CID 176844324
6-phenyl-N,N-bis(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-9-amine
CID 176844541
10-[3,5-bis(12-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-10-yl)phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene
CID 121325371
6-[4-[2,3-di(ethylidene)-4-phenylnaphthalen-1-yl]phenyl]naphtho[2,1-b][1]benzofuran
CID 123620919
9,10-dimethoxy-6-[4-(trifluoromethyl)phenyl]naphtho[2,1-b][1]benzofuran
CID 155754001
6-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran
CID 86667299
8-methoxynaphtho[1,2-c]chromen-5-one
CID 118617567
1-methoxy-4-phenylnaphtho[2,3-b][1]benzofuran
CID 167077293
3-[4-(12-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-10-yl)phenyl]pyridine
CID 118944273
10-[10-(12-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-10-yl)anthracen-9-yl]-12-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene
CID 121325314
6,20-dimethoxy-13-phenyl-9,17-dioxa-1-azaheptacyclo[13.9.1.02,10.03,8.011,25.016,24.018,23]pentacosa-2(10),3(8),4,6,11,13,15(25),16(24),18(23),19,21-undecaene
CID 167209764
6-[3-(9,10-diphenylanthracen-2-yl)phenyl]naphtho[2,1-b][1]benzofuran
CID 88539783

Frequently Asked Questions

What is the IUPAC name of 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran?
The IUPAC name of 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran (CID 155128175) is 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran.
What is the SMILES notation for 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran?
The canonical SMILES for 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran is COc1ccc2c(c1)oc1c(-c3ccccc3)cc3ccccc3c12.
What is the InChIKey of 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran?
The InChIKey is YNMOJPIUFMPTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16O2/c1-24-17-11-12-19-21(14-17)25-23-20(15-7-3-2-4-8-15)13-16-9-5-6-10-18(16)22(19)23/h2-14H,1H3.
What are the key properties of 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran?
9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran has a molecular weight of 324.38 g/mol, XLogP of 6.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methoxy-6-phenylnaphtho[2,1-b][1]benzofuran is sourced from PubChem (CID 155128175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).