7,10-dihydro-6H-benzo[b][1]benzazepine

C14H13N — CID 22063027

IUPAC7,10-dihydro-6H-benzo[b][1]benzazepine
SMILESC1=CCC2=C(C1)CC=c1ccccc1=N2
InChIInChI=1S/C14H13N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-5,7,9H,6,8,10H2
InChIKeyRNKQODRJRZZLBO-UHFFFAOYSA-N
MW195.27 g/mol
LogP2.09
Rot. Bonds

About 7,10-dihydro-6H-benzo[b][1]benzazepine

7,10-dihydro-6H-benzo[b][1]benzazepine (PubChem CID 22063027) has the molecular formula C14H13N and a molecular weight of 195.27 g/mol. Its IUPAC name is 7,10-dihydro-6H-benzo[b][1]benzazepine.

Molecular Properties

Compound Name7,10-dihydro-6H-benzo[b][1]benzazepine
PubChem CID22063027
Molecular FormulaC14H13N
Molecular Weight195.27 g/mol
Exact Mass195.10
IUPAC Name7,10-dihydro-6H-benzo[b][1]benzazepine
SMILESC1=CCC2=C(C1)CC=c1ccccc1=N2
InChIInChI=1S/C14H13N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-5,7,9H,6,8,10H2
InChIKeyRNKQODRJRZZLBO-UHFFFAOYSA-N
XLogP2.09
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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2H-carbazole
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Cyclopentacarbazole
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Dihydroindeno[1,2-b]indole
CID 69302209
10,11-Dihydro-dibenzazepine
CID 126697729
Dibenzocycloheptenimin
CID 129628903
1H-Benzo(a)carbazole
CID 114645
2,2,4-Trimethyl-2,6-dihydroquinoline
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6h-Indeno[1,2-b]quinoline
CID 129804586
(1Z,9Z)-9,10-dimethyl-8,11-diazatricyclo[10.4.0.02,7]hexadeca-1,3,5,7,9,11,13,15-octaene
CID 134989464
2-(trifluoromethyl)-7H-1-benzazepine
CID 150911750

Frequently Asked Questions

What is the IUPAC name of 7,10-dihydro-6H-benzo[b][1]benzazepine?
The IUPAC name of 7,10-dihydro-6H-benzo[b][1]benzazepine (CID 22063027) is 7,10-dihydro-6H-benzo[b][1]benzazepine.
What is the SMILES notation for 7,10-dihydro-6H-benzo[b][1]benzazepine?
The canonical SMILES for 7,10-dihydro-6H-benzo[b][1]benzazepine is C1=CCC2=C(C1)CC=c1ccccc1=N2.
What is the InChIKey of 7,10-dihydro-6H-benzo[b][1]benzazepine?
The InChIKey is RNKQODRJRZZLBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-5,7,9H,6,8,10H2.
What are the key properties of 7,10-dihydro-6H-benzo[b][1]benzazepine?
7,10-dihydro-6H-benzo[b][1]benzazepine has a molecular weight of 195.27 g/mol, XLogP of 2.09, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,10-dihydro-6H-benzo[b][1]benzazepine is sourced from PubChem (CID 22063027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).