8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one

C15H15NO — CID 145135540

IUPAC8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one
SMILESCc1cc2n(c(=O)c1)Cc1ccccc1CC2
InChIInChI=1S/C15H15NO/c1-11-8-14-7-6-12-4-2-3-5-13(12)10-16(14)15(17)9-11/h2-5,8-9H,6-7,10H2,1H3
InChIKeyXNGDKFSEJAQFQN-UHFFFAOYSA-N
MW225.29 g/mol
LogP2.30
Rot. Bonds

About 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one

8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one (PubChem CID 145135540) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one.

Molecular Properties

Compound Name8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one
PubChem CID145135540
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one
SMILESCc1cc2n(c(=O)c1)Cc1ccccc1CC2
InChIInChI=1S/C15H15NO/c1-11-8-14-7-6-12-4-2-3-5-13(12)10-16(14)15(17)9-11/h2-5,8-9H,6-7,10H2,1H3
InChIKeyXNGDKFSEJAQFQN-UHFFFAOYSA-N
XLogP2.30
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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(6aS)-5,6,6a,7,8,11-hexahydropyrrolo[1,2-b][2]benzazepin-9-one
CID 139043408
3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-5-methylaniline
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ethane;2-methyl-4,5,9,10-tetrahydropyrene
CID 91241370
ethane;2-methyl-4,5,9,10-tetrahydropyrene
CID 144543507
bicyclo[4.2.0]octa-1,3,5-triene;2,3-dihydro-1H-indene;5,6,7,8,9,10-hexahydrobenzo[8]annulene;6,7,8,9,10,11-hexahydro-5H-benzo[9]annulene;5,6,7,8,9,10,11,12-octahydrobenzo[10]annulene;6,7,8,9-tetrahydro-5H-benzo[7]annulene;1,2,3,4-tetrahydronaphthalene;1,2-xylene
CID 159244193
methane;2-methyl-3,4-dihydro-1H-isoquinoline
CID 161283116
N-methyl-3-oxo-4,5-dihydro-1H-2-benzazepine-2-carboxamide
CID 3050354
8,9-dihydro-6H-pyrido[1,2-a]indol-7-one
CID 15063399
3,4-dihydro-1H-isoquinolin-2-yl-[1-(3,5-dimethylphenyl)triazol-4-yl]methanone
CID 53489562
2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4,6-dimethylphenol
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Frequently Asked Questions

What is the IUPAC name of 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one?
The IUPAC name of 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one (CID 145135540) is 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one.
What is the SMILES notation for 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one?
The canonical SMILES for 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one is Cc1cc2n(c(=O)c1)Cc1ccccc1CC2.
What is the InChIKey of 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one?
The InChIKey is XNGDKFSEJAQFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-11-8-14-7-6-12-4-2-3-5-13(12)10-16(14)15(17)9-11/h2-5,8-9H,6-7,10H2,1H3.
What are the key properties of 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one?
8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one has a molecular weight of 225.29 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-6,12-dihydro-5H-pyrido[1,2-b][2]benzazepin-10-one is sourced from PubChem (CID 145135540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).