5-methyl-3-phenyl-1H-2-benzazepine

C17H15N — CID 10633403

IUPAC5-methyl-3-phenyl-1H-2-benzazepine
SMILESCC1=CC(c2ccccc2)=NCc2ccccc21
InChIInChI=1S/C17H15N/c1-13-11-17(14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(13)15/h2-11H,12H2,1H3
InChIKeyHPLGEQYVOFWJIQ-UHFFFAOYSA-N
MW233.31 g/mol
LogP4.09
Rot. Bonds1

About 5-methyl-3-phenyl-1H-2-benzazepine

5-methyl-3-phenyl-1H-2-benzazepine (PubChem CID 10633403) has the molecular formula C17H15N and a molecular weight of 233.31 g/mol. Its IUPAC name is 5-methyl-3-phenyl-1H-2-benzazepine.

Molecular Properties

Compound Name5-methyl-3-phenyl-1H-2-benzazepine
PubChem CID10633403
Molecular FormulaC17H15N
Molecular Weight233.31 g/mol
Exact Mass233.12
IUPAC Name5-methyl-3-phenyl-1H-2-benzazepine
SMILESCC1=CC(c2ccccc2)=NCc2ccccc21
InChIInChI=1S/C17H15N/c1-13-11-17(14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(13)15/h2-11H,12H2,1H3
InChIKeyHPLGEQYVOFWJIQ-UHFFFAOYSA-N
XLogP4.09
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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2-methyl-4-(3-phenylphenyl)-1H-indene
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N,N-dimethyl-4-phenyl-1H-inden-2-amine
CID 151077221
ethane;3-(3-methylbut-2-en-2-yl)-1H-isoindole
CID 158932732
ethane;3-methyl-1H-indene
CID 90920725
4-(2-methylphenyl)-2-phenyl-1H-indene
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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-phenyl-1H-2-benzazepine?
The IUPAC name of 5-methyl-3-phenyl-1H-2-benzazepine (CID 10633403) is 5-methyl-3-phenyl-1H-2-benzazepine.
What is the SMILES notation for 5-methyl-3-phenyl-1H-2-benzazepine?
The canonical SMILES for 5-methyl-3-phenyl-1H-2-benzazepine is CC1=CC(c2ccccc2)=NCc2ccccc21.
What is the InChIKey of 5-methyl-3-phenyl-1H-2-benzazepine?
The InChIKey is HPLGEQYVOFWJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N/c1-13-11-17(14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(13)15/h2-11H,12H2,1H3.
What are the key properties of 5-methyl-3-phenyl-1H-2-benzazepine?
5-methyl-3-phenyl-1H-2-benzazepine has a molecular weight of 233.31 g/mol, XLogP of 4.09, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-phenyl-1H-2-benzazepine is sourced from PubChem (CID 10633403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).