10,11-dihydro-9H-benzo[d][1]benzazepine

C14H13N — CID 126697729

IUPAC10,11-dihydro-9H-benzo[d][1]benzazepine
SMILESC1=CC2=CCCCC2=c2ccccc2=N1
InChIInChI=1S/C14H13N/c1-2-6-12-11(5-1)9-10-15-14-8-4-3-7-13(12)14/h3-5,7-10H,1-2,6H2
InChIKeyILHYRNCXUBXJRW-UHFFFAOYSA-N
MW195.27 g/mol
LogP2.09
Rot. Bonds

About 10,11-dihydro-9H-benzo[d][1]benzazepine

10,11-dihydro-9H-benzo[d][1]benzazepine (PubChem CID 126697729) has the molecular formula C14H13N and a molecular weight of 195.27 g/mol. Its IUPAC name is 10,11-dihydro-9H-benzo[d][1]benzazepine.

Molecular Properties

Compound Name10,11-dihydro-9H-benzo[d][1]benzazepine
PubChem CID126697729
Molecular FormulaC14H13N
Molecular Weight195.27 g/mol
Exact Mass195.10
IUPAC Name10,11-dihydro-9H-benzo[d][1]benzazepine
SMILESC1=CC2=CCCCC2=c2ccccc2=N1
InChIInChI=1S/C14H13N/c1-2-6-12-11(5-1)9-10-15-14-8-4-3-7-13(12)14/h3-5,7-10H,1-2,6H2
InChIKeyILHYRNCXUBXJRW-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

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Frequently Asked Questions

What is the IUPAC name of 10,11-dihydro-9H-benzo[d][1]benzazepine?
The IUPAC name of 10,11-dihydro-9H-benzo[d][1]benzazepine (CID 126697729) is 10,11-dihydro-9H-benzo[d][1]benzazepine.
What is the SMILES notation for 10,11-dihydro-9H-benzo[d][1]benzazepine?
The canonical SMILES for 10,11-dihydro-9H-benzo[d][1]benzazepine is C1=CC2=CCCCC2=c2ccccc2=N1.
What is the InChIKey of 10,11-dihydro-9H-benzo[d][1]benzazepine?
The InChIKey is ILHYRNCXUBXJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N/c1-2-6-12-11(5-1)9-10-15-14-8-4-3-7-13(12)14/h3-5,7-10H,1-2,6H2.
What are the key properties of 10,11-dihydro-9H-benzo[d][1]benzazepine?
10,11-dihydro-9H-benzo[d][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 10,11-dihydro-9H-benzo[d][1]benzazepine is sourced from PubChem (CID 126697729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).