9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one

C18H15ClN4O2 — CID 171350845

IUPAC9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one
SMILESCOc1cc(Cl)c2c(c1)n(Cc1cnccc1C)c(=O)c1cncn12
InChIInChI=1S/C18H15ClN4O2/c1-11-3-4-20-7-12(11)9-22-15-6-13(25-2)5-14(19)17(15)23-10-21-8-16(23)18(22)24/h3-8,10H,9H2,1-2H3
InChIKeyJAFQLIBAKORRJE-UHFFFAOYSA-N
MW354.80 g/mol
LogP3.06
Rot. Bonds3

About 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one

9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one (PubChem CID 171350845) has the molecular formula C18H15ClN4O2 and a molecular weight of 354.80 g/mol. Its IUPAC name is 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one.

Molecular Properties

Compound Name9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one
PubChem CID171350845
Molecular FormulaC18H15ClN4O2
Molecular Weight354.80 g/mol
Exact Mass354.09
IUPAC Name9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one
SMILESCOc1cc(Cl)c2c(c1)n(Cc1cnccc1C)c(=O)c1cncn12
InChIInChI=1S/C18H15ClN4O2/c1-11-3-4-20-7-12(11)9-22-15-6-13(25-2)5-14(19)17(15)23-10-21-8-16(23)18(22)24/h3-8,10H,9H2,1-2H3
InChIKeyJAFQLIBAKORRJE-UHFFFAOYSA-N
XLogP3.06
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.80
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one with MolForge

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Related Compounds

6-Chloro-8-methoxy-3,4-dimethyl-1-(3-methyl-4-pyridinyl)imidazo[1,5-a]quinoxaline
CID 49821714
6-Chloro-3-(4-methoxyphenyl)-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one
CID 10690352
(4-(3-chlorophenyl)piperazin-1-yl)(1-(3-methoxyphenyl)-2-p-tolyl-1H-imidazol-4-yl)methanone
CID 44578251
8-Methoxy-5-(pyridin-3-ylmethyl)imidazo[1,5-a]quinoxalin-4-one
CID 171351551
5-(Pyridin-3-ylmethyl)-8-(trifluoromethoxy)imidazo[1,5-a]quinoxalin-4-one
CID 171355597
9-Chloro-7-methoxy-5-(pyridin-3-ylmethyl)imidazo[1,5-a]quinoxalin-4-one
CID 171356264
7-Methoxy-5-(pyridin-3-ylmethyl)imidazo[1,5-a]quinoxalin-4-one
CID 171356872
(6-Chloroimidazo[1,2-a]pyridin-2-yl)(4-(4-methoxyphenyl)piperazin-1-yl)methanone
CID 15409145
5-[2-Chloro-4-(difluoromethoxy)phenyl]-1-methyl-7-(trifluoromethyl)imidazo[4,5-c][1,8]naphthyridin-4-one
CID 164562901
1-(3-Methoxyphenyl)-4-{7-methylimidazo[1,2-A]pyridine-2-carbonyl}piperazine
CID 28685547
[4-(3-Methoxyphenyl)piperazino](8-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 87051370
1-(3-Methoxyphenyl)-4-{6-methylimidazo[1,2-A]pyridine-2-carbonyl}piperazine
CID 87051420

Frequently Asked Questions

What is the IUPAC name of 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one?
The IUPAC name of 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one (CID 171350845) is 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one.
What is the SMILES notation for 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one?
The canonical SMILES for 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one is COc1cc(Cl)c2c(c1)n(Cc1cnccc1C)c(=O)c1cncn12.
What is the InChIKey of 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one?
The InChIKey is JAFQLIBAKORRJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN4O2/c1-11-3-4-20-7-12(11)9-22-15-6-13(25-2)5-14(19)17(15)23-10-21-8-16(23)18(22)24/h3-8,10H,9H2,1-2H3.
What are the key properties of 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one?
9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one has a molecular weight of 354.80 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-chloro-7-methoxy-5-[(4-methyl-3-pyridinyl)methyl]imidazo[1,5-a]quinoxalin-4-one is sourced from PubChem (CID 171350845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).