(2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone

C19H20N4O — CID 70754256

IUPAC(2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone
SMILESCc1ccc2nc(C)cc(C(=O)N3CCCn4cncc4C3)c2c1
InChIInChI=1S/C19H20N4O/c1-13-4-5-18-16(8-13)17(9-14(2)21-18)19(24)22-6-3-7-23-12-20-10-15(23)11-22/h4-5,8-10,12H,3,6-7,11H2,1-2H3
InChIKeyBSXNTVOLKRUUOU-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.09
Rot. Bonds1

About (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone

(2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone (PubChem CID 70754256) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone.

Molecular Properties

Compound Name(2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone
PubChem CID70754256
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name(2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone
SMILESCc1ccc2nc(C)cc(C(=O)N3CCCn4cncc4C3)c2c1
InChIInChI=1S/C19H20N4O/c1-13-4-5-18-16(8-13)17(9-14(2)21-18)19(24)22-6-3-7-23-12-20-10-15(23)11-22/h4-5,8-10,12H,3,6-7,11H2,1-2H3
InChIKeyBSXNTVOLKRUUOU-UHFFFAOYSA-N
XLogP3.09
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(2,6-dimethylquinoline-4-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone
CID 35614892
[(3R,4R)-3,4-dihydroxypiperidin-1-yl]-(2,6-dimethylquinolin-4-yl)methanone
CID 133124655
(2,6-dimethylquinolin-4-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 18145987
(2,6-dimethylquinolin-4-yl)-[4-[(3S,4R)-4-hydroxyoxolan-3-yl]-1,4-diazepan-1-yl]methanone
CID 70781341
azepan-1-yl-(6-fluoro-2-methylquinolin-4-yl)methanone
CID 4732287
(6-amino-2-methylquinolin-4-yl)-piperidin-1-ylmethanone
CID 110489432
(2,4-dimethoxyphenyl)-[4-(2,6-dimethylquinoline-4-carbonyl)piperazin-1-yl]methanone
CID 55904206
N-(2,5-dimethylphenyl)-N-ethyl-2,6-dimethylquinoline-4-carboxamide
CID 55591955
[2-(4-fluorophenyl)-6-methylquinolin-4-yl]-piperidin-1-ylmethanone
CID 42749728
[2-(4-bromophenyl)-6-methylquinolin-4-yl]-piperidin-1-ylmethanone
CID 17386031
(3-cyclopropyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)-(2,6-dimethylquinolin-4-yl)methanone;2,2,2-trifluoroacetic acid
CID 154887221
(2,6-dimethylquinolin-4-yl)-[2-methyl-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-5,7-dihydro-4H-pyrazolo[3,4-c]pyridin-6-yl]methanone
CID 166766823

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone?
The IUPAC name of (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone (CID 70754256) is (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone.
What is the SMILES notation for (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone?
The canonical SMILES for (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone is Cc1ccc2nc(C)cc(C(=O)N3CCCn4cncc4C3)c2c1.
What is the InChIKey of (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone?
The InChIKey is BSXNTVOLKRUUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13-4-5-18-16(8-13)17(9-14(2)21-18)19(24)22-6-3-7-23-12-20-10-15(23)11-22/h4-5,8-10,12H,3,6-7,11H2,1-2H3.
What are the key properties of (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone?
(2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone has a molecular weight of 320.40 g/mol, XLogP of 3.09, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylquinolin-4-yl)-(5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-8-yl)methanone is sourced from PubChem (CID 70754256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).