2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine

C26H23NO — CID 59572264

IUPAC2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine
SMILESCc1ccc2c(c1)CCc1cc(C)oc1N2c1ccccc1-c1ccccc1
InChIInChI=1S/C26H23NO/c1-18-12-15-24-21(16-18)13-14-22-17-19(2)28-26(22)27(24)25-11-7-6-10-23(25)20-8-4-3-5-9-20/h3-12,15-17H,13-14H2,1-2H3
InChIKeyMSPXBQNVQVYCQV-UHFFFAOYSA-N
MW365.48 g/mol
LogP7.13
Rot. Bonds2

About 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine

2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine (PubChem CID 59572264) has the molecular formula C26H23NO and a molecular weight of 365.48 g/mol. Its IUPAC name is 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine.

Molecular Properties

Compound Name2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine
PubChem CID59572264
Molecular FormulaC26H23NO
Molecular Weight365.48 g/mol
Exact Mass365.18
IUPAC Name2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine
SMILESCc1ccc2c(c1)CCc1cc(C)oc1N2c1ccccc1-c1ccccc1
InChIInChI=1S/C26H23NO/c1-18-12-15-24-21(16-18)13-14-22-17-19(2)28-26(22)27(24)25-11-7-6-10-23(25)20-8-4-3-5-9-20/h3-12,15-17H,13-14H2,1-2H3
InChIKeyMSPXBQNVQVYCQV-UHFFFAOYSA-N
XLogP7.13
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.48
LogP ≤ 57.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine?
The IUPAC name of 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine (CID 59572264) is 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine.
What is the SMILES notation for 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine?
The canonical SMILES for 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine is Cc1ccc2c(c1)CCc1cc(C)oc1N2c1ccccc1-c1ccccc1.
What is the InChIKey of 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine?
The InChIKey is MSPXBQNVQVYCQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23NO/c1-18-12-15-24-21(16-18)13-14-22-17-19(2)28-26(22)27(24)25-11-7-6-10-23(25)20-8-4-3-5-9-20/h3-12,15-17H,13-14H2,1-2H3.
What are the key properties of 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine?
2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine has a molecular weight of 365.48 g/mol, XLogP of 7.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-10-(2-phenylphenyl)-4,5-dihydrofuro[2,3-b][1]benzazepine is sourced from PubChem (CID 59572264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).