1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one

C14H14N2O — CID 68765659

IUPAC1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one
SMILESCc1nc2n(c1C)Cc1ccccc1CC2=O
InChIInChI=1S/C14H14N2O/c1-9-10(2)16-8-12-6-4-3-5-11(12)7-13(17)14(16)15-9/h3-6H,7-8H2,1-2H3
InChIKeyCFBMVZDXZGORKT-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.29
Rot. Bonds

About 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one

1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one (PubChem CID 68765659) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one.

Molecular Properties

Compound Name1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one
PubChem CID68765659
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one
SMILESCc1nc2n(c1C)Cc1ccccc1CC2=O
InChIInChI=1S/C14H14N2O/c1-9-10(2)16-8-12-6-4-3-5-11(12)7-13(17)14(16)15-9/h3-6H,7-8H2,1-2H3
InChIKeyCFBMVZDXZGORKT-UHFFFAOYSA-N
XLogP2.29
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one?
The IUPAC name of 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one (CID 68765659) is 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one.
What is the SMILES notation for 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one?
The canonical SMILES for 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one is Cc1nc2n(c1C)Cc1ccccc1CC2=O.
What is the InChIKey of 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one?
The InChIKey is CFBMVZDXZGORKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-9-10(2)16-8-12-6-4-3-5-11(12)7-13(17)14(16)15-9/h3-6H,7-8H2,1-2H3.
What are the key properties of 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one?
1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one has a molecular weight of 226.28 g/mol, XLogP of 2.29, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-5,10-dihydroimidazo[1,2-b][2]benzazepin-4-one is sourced from PubChem (CID 68765659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).