3H-imidazo[1,2-b][2]benzazepine

C12H10N2 — CID 57030394

IUPAC3H-imidazo[1,2-b][2]benzazepine
SMILESC1=CN2C=c3ccccc3=CC=C2N1
InChIInChI=1S/C12H10N2/c1-2-4-11-9-14-8-7-13-12(14)6-5-10(11)3-1/h1-9,13H
InChIKeyKDIZCMKKXVUTMK-UHFFFAOYSA-N
MW182.23 g/mol
LogP0.44
Rot. Bonds

About 3H-imidazo[1,2-b][2]benzazepine

3H-imidazo[1,2-b][2]benzazepine (PubChem CID 57030394) has the molecular formula C12H10N2 and a molecular weight of 182.23 g/mol. Its IUPAC name is 3H-imidazo[1,2-b][2]benzazepine.

Molecular Properties

Compound Name3H-imidazo[1,2-b][2]benzazepine
PubChem CID57030394
Molecular FormulaC12H10N2
Molecular Weight182.23 g/mol
Exact Mass182.08
IUPAC Name3H-imidazo[1,2-b][2]benzazepine
SMILESC1=CN2C=c3ccccc3=CC=C2N1
InChIInChI=1S/C12H10N2/c1-2-4-11-9-14-8-7-13-12(14)6-5-10(11)3-1/h1-9,13H
InChIKeyKDIZCMKKXVUTMK-UHFFFAOYSA-N
XLogP0.44
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3H-imidazo[1,2-b][2]benzazepine?
The IUPAC name of 3H-imidazo[1,2-b][2]benzazepine (CID 57030394) is 3H-imidazo[1,2-b][2]benzazepine.
What is the SMILES notation for 3H-imidazo[1,2-b][2]benzazepine?
The canonical SMILES for 3H-imidazo[1,2-b][2]benzazepine is C1=CN2C=c3ccccc3=CC=C2N1.
What is the InChIKey of 3H-imidazo[1,2-b][2]benzazepine?
The InChIKey is KDIZCMKKXVUTMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2/c1-2-4-11-9-14-8-7-13-12(14)6-5-10(11)3-1/h1-9,13H.
What are the key properties of 3H-imidazo[1,2-b][2]benzazepine?
3H-imidazo[1,2-b][2]benzazepine has a molecular weight of 182.23 g/mol, XLogP of 0.44, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-imidazo[1,2-b][2]benzazepine is sourced from PubChem (CID 57030394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).