1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one

C24H23N7O2 — CID 59619665

IUPAC1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one
SMILESCc1nn(C)cc1-n1c(=O)n(C)c2cnc3ccc(-c4cnc5c(c4)OCCN5C)cc3c21
InChIInChI=1S/C24H23N7O2/c1-14-20(13-29(3)27-14)31-22-17-9-15(5-6-18(17)25-12-19(22)30(4)24(31)32)16-10-21-23(26-11-16)28(2)7-8-33-21/h5-6,9-13H,7-8H2,1-4H3
InChIKeyFROZIHADXIQWOU-UHFFFAOYSA-N
MW441.50 g/mol
LogP2.81
Rot. Bonds2

About 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one

1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one (PubChem CID 59619665) has the molecular formula C24H23N7O2 and a molecular weight of 441.50 g/mol. Its IUPAC name is 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one
PubChem CID59619665
Molecular FormulaC24H23N7O2
Molecular Weight441.50 g/mol
Exact Mass441.19
IUPAC Name1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one
SMILESCc1nn(C)cc1-n1c(=O)n(C)c2cnc3ccc(-c4cnc5c(c4)OCCN5C)cc3c21
InChIInChI=1S/C24H23N7O2/c1-14-20(13-29(3)27-14)31-22-17-9-15(5-6-18(17)25-12-19(22)30(4)24(31)32)16-10-21-23(26-11-16)28(2)7-8-33-21/h5-6,9-13H,7-8H2,1-4H3
InChIKeyFROZIHADXIQWOU-UHFFFAOYSA-N
XLogP2.81
TPSA83.00 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.50
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one with MolForge

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Related Compounds

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CID 44181148
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CID 44181149
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CID 126689144
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CID 138490470
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CID 146592000
CID 146592000

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one?
The IUPAC name of 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one (CID 59619665) is 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one is Cc1nn(C)cc1-n1c(=O)n(C)c2cnc3ccc(-c4cnc5c(c4)OCCN5C)cc3c21.
What is the InChIKey of 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one?
The InChIKey is FROZIHADXIQWOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N7O2/c1-14-20(13-29(3)27-14)31-22-17-9-15(5-6-18(17)25-12-19(22)30(4)24(31)32)16-10-21-23(26-11-16)28(2)7-8-33-21/h5-6,9-13H,7-8H2,1-4H3.
What are the key properties of 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one?
1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one has a molecular weight of 441.50 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazin-7-yl)imidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 59619665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).