[4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone

C20H23N5O4 — CID 23934063

IUPAC[4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone
SMILESCNc1nc2cc(OC)c(OC)cc2nc1N1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C20H23N5O4/c1-21-18-19(23-14-12-17(28-3)16(27-2)11-13(14)22-18)24-6-8-25(9-7-24)20(26)15-5-4-10-29-15/h4-5,10-12H,6-9H2,1-3H3,(H,21,22)
InChIKeyKIOXGCGOAAOYQQ-UHFFFAOYSA-N
MW397.44 g/mol
LogP2.24
Rot. Bonds5

About [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone

[4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone (PubChem CID 23934063) has the molecular formula C20H23N5O4 and a molecular weight of 397.44 g/mol. Its IUPAC name is [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone
PubChem CID23934063
Molecular FormulaC20H23N5O4
Molecular Weight397.44 g/mol
Exact Mass397.18
IUPAC Name[4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone
SMILESCNc1nc2cc(OC)c(OC)cc2nc1N1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C20H23N5O4/c1-21-18-19(23-14-12-17(28-3)16(27-2)11-13(14)22-18)24-6-8-25(9-7-24)20(26)15-5-4-10-29-15/h4-5,10-12H,6-9H2,1-3H3,(H,21,22)
InChIKeyKIOXGCGOAAOYQQ-UHFFFAOYSA-N
XLogP2.24
TPSA92.96 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.44
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone with MolForge

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Related Compounds

[4-[4-(benzylamino)-6,7-dimethoxyquinazolin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone
CID 44523465
[4-(4-amino-6,7-dimethoxyquinazolin-3-ium-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 6200102
[4-(1-amino-6,7-dimethoxyisoquinolin-3-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 14068977
ethyl 6,7-dichloro-3-[4-(furan-2-carbonyl)piperazin-1-yl]quinoxaline-2-carboxylate
CID 46091300
3-chloro-N-[3-[4-(furan-2-carbonyl)piperazin-1-yl]quinoxalin-2-yl]benzenesulfonamide
CID 27815789
[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 3433092
[4-(8,9-dimethoxy-2-methyl-2-oxo-2lambda6-thia-3,5-diazabicyclo[4.4.0]deca-1(10),2,4,6,8-pentaen-4-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 12694316
furan-2-yl-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]methanone
CID 16883392
furan-2-yl-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]methanone
CID 171690760
furan-2-yl-[4-[2-(2-methoxyanilino)pyrimidin-4-yl]piperazin-1-yl]methanone
CID 112898656
furan-2-yl-[4-(2-methoxy-4,6-dimethylbenzoyl)piperazin-1-yl]methanone
CID 110764965
N-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-4-methoxyphenyl]acetamide
CID 110801888

Frequently Asked Questions

What is the IUPAC name of [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone?
The IUPAC name of [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone (CID 23934063) is [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone?
The canonical SMILES for [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone is CNc1nc2cc(OC)c(OC)cc2nc1N1CCN(C(=O)c2ccco2)CC1.
What is the InChIKey of [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone?
The InChIKey is KIOXGCGOAAOYQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O4/c1-21-18-19(23-14-12-17(28-3)16(27-2)11-13(14)22-18)24-6-8-25(9-7-24)20(26)15-5-4-10-29-15/h4-5,10-12H,6-9H2,1-3H3,(H,21,22).
What are the key properties of [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone?
[4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone has a molecular weight of 397.44 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6,7-dimethoxy-3-(methylamino)quinoxalin-2-yl]piperazin-1-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 23934063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).