8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine

C21H20N4O — CID 66863134

IUPAC8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine
SMILESCc1nc(-c2ccccc2)n2c1c(N)nc1ccc(OCC3CC3)cc12
InChIInChI=1S/C21H20N4O/c1-13-19-20(22)24-17-10-9-16(26-12-14-7-8-14)11-18(17)25(19)21(23-13)15-5-3-2-4-6-15/h2-6,9-11,14H,7-8,12H2,1H3,(H2,22,24)
InChIKeyCJUOCCNVEDVKMR-UHFFFAOYSA-N
MW344.42 g/mol
LogP4.23
Rot. Bonds4

About 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine

8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine (PubChem CID 66863134) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine.

Molecular Properties

Compound Name8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine
PubChem CID66863134
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC Name8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine
SMILESCc1nc(-c2ccccc2)n2c1c(N)nc1ccc(OCC3CC3)cc12
InChIInChI=1S/C21H20N4O/c1-13-19-20(22)24-17-10-9-16(26-12-14-7-8-14)11-18(17)25(19)21(23-13)15-5-3-2-4-6-15/h2-6,9-11,14H,7-8,12H2,1H3,(H2,22,24)
InChIKeyCJUOCCNVEDVKMR-UHFFFAOYSA-N
XLogP4.23
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine?
The IUPAC name of 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine (CID 66863134) is 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine.
What is the SMILES notation for 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine?
The canonical SMILES for 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine is Cc1nc(-c2ccccc2)n2c1c(N)nc1ccc(OCC3CC3)cc12.
What is the InChIKey of 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine?
The InChIKey is CJUOCCNVEDVKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O/c1-13-19-20(22)24-17-10-9-16(26-12-14-7-8-14)11-18(17)25(19)21(23-13)15-5-3-2-4-6-15/h2-6,9-11,14H,7-8,12H2,1H3,(H2,22,24).
What are the key properties of 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine?
8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine has a molecular weight of 344.42 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(cyclopropylmethoxy)-3-methyl-1-phenylimidazo[1,5-a]quinoxalin-4-amine is sourced from PubChem (CID 66863134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).