4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine

C128H176ClN29O17 — CID 160648965

IUPAC4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine
SMILESCCOCC.CCOCC.CCOCC.CCOCC.CCOCC.CCOCC.COC(=O)C1CCC(Oc2cc(N)cc3nccnc23)CC1.Cc1cncc(NC2CCC(Oc3cc(N)cc4nccnc34)CC2)n1.Nc1cc(NC2CCC(Oc3ncccn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(C(=O)O)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Nc3ccc(Cl)nn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Oc3ncccn3)CC2)c2nccnc2c1
InChIInChI=1S/C19H22N6O.C18H19ClN6O.C18H20N6O.C18H19N5O2.C16H19N3O3.C15H17N3O3.6C4H10O/c1-12-10-21-11-18(24-12)25-14-2-4-15(5-3-14)26-17-9-13(20)8-16-19(17)23-7-6-22-16;19-16-5-6-17(25-24-16)23-12-1-3-13(4-2-12)26-15-10-11(20)9-14-18(15)22-8-7-21-14;2*19-12-10-15-17(21-9-8-20-15)16(11-12)24-13-2-4-14(5-3-13)25-18-22-6-1-7-23-18;1-21-16(20)10-2-4-12(5-3-10)22-14-9-11(17)8-13-15(14)19-7-6-18-13;16-10-7-12-14(18-6-5-17-12)13(8-10)21-11-3-1-9(2-4-11)15(19)20;6*1-3-5-4-2/h6-11,14-15H,2-5,20H2,1H3,(H,24,25);5-10,12-13H,1-4,20H2,(H,23,25);1,6-11,13-14,24H,2-5,19H2;1,6-11,13-14H,2-5,19H2;6-10,12H,2-5,17H2,1H3;5-9,11H,1-4,16H2,(H,19,20);6*3-4H2,1-2H3
InChIKeyRKDYGWWSVUJRBC-UHFFFAOYSA-N
MW2428.45 g/mol
LogP22.96
Rot. Bonds34

About 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine

4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine (PubChem CID 160648965) has the molecular formula C128H176ClN29O17 and a molecular weight of 2428.45 g/mol. Its IUPAC name is 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine.

Molecular Properties

Compound Name4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine
PubChem CID160648965
Molecular FormulaC128H176ClN29O17
Molecular Weight2428.45 g/mol
Exact Mass2426.35
IUPAC Name4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine
SMILESCCOCC.CCOCC.CCOCC.CCOCC.CCOCC.CCOCC.COC(=O)C1CCC(Oc2cc(N)cc3nccnc23)CC1.Cc1cncc(NC2CCC(Oc3cc(N)cc4nccnc34)CC2)n1.Nc1cc(NC2CCC(Oc3ncccn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(C(=O)O)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Nc3ccc(Cl)nn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Oc3ncccn3)CC2)c2nccnc2c1
InChIInChI=1S/C19H22N6O.C18H19ClN6O.C18H20N6O.C18H19N5O2.C16H19N3O3.C15H17N3O3.6C4H10O/c1-12-10-21-11-18(24-12)25-14-2-4-15(5-3-14)26-17-9-13(20)8-16-19(17)23-7-6-22-16;19-16-5-6-17(25-24-16)23-12-1-3-13(4-2-12)26-15-10-11(20)9-14-18(15)22-8-7-21-14;2*19-12-10-15-17(21-9-8-20-15)16(11-12)24-13-2-4-14(5-3-13)25-18-22-6-1-7-23-18;1-21-16(20)10-2-4-12(5-3-10)22-14-9-11(17)8-13-15(14)19-7-6-18-13;16-10-7-12-14(18-6-5-17-12)13(8-10)21-11-3-1-9(2-4-11)15(19)20;6*1-3-5-4-2/h6-11,14-15H,2-5,20H2,1H3,(H,24,25);5-10,12-13H,1-4,20H2,(H,23,25);1,6-11,13-14,24H,2-5,19H2;1,6-11,13-14H,2-5,19H2;6-10,12H,2-5,17H2,1H3;5-9,11H,1-4,16H2,(H,19,20);6*3-4H2,1-2H3
InChIKeyRKDYGWWSVUJRBC-UHFFFAOYSA-N
XLogP22.96
TPSA633.60 Ų
H-Bond Donors10
H-Bond Acceptors45
Rotatable Bonds34
Heavy Atoms175
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002428.45
LogP ≤ 522.96
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1045

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine with MolForge

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Related Compounds

8-[4-[(6-chloropyrimidin-4-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;8-[4-[(5-fluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;methyl 5-[[4-[(7-aminoquinoxalin-5-yl)amino]cyclohexyl]amino]pyrazine-2-carboxylate;8-[4-(pyrazin-2-ylamino)cyclohexyl]oxyquinoxalin-6-amine;8-[4-(pyrimidin-2-ylamino)cyclohexyl]oxyquinoxalin-6-amine
CID 158838158
6-[[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]amino]-N-methylpyridine-3-carboxamide
CID 156630311
N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide
CID 156673154
2-[[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]amino]pyrimidine-4-carbonitrile;4-N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-6-N-methylpyrimidine-4,6-diamine;4-(7-aminoquinoxalin-5-yl)oxy-N-(1-methylimidazol-2-yl)cyclohexane-1-carboxamide;8-[4-[(6-chloro-2-methoxypyrimidin-4-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;8-[4-[(5-methoxy-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine
CID 160987086
8-[4-[[6-methyl-5-(1,3,4-oxadiazol-2-yl)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine
CID 156673200
prop-2-ynyl N-[4-[(7-aminoquinoxalin-5-yl)amino]cyclohexyl]carbamate
CID 156672987
ethyl 4-pyrimidin-2-yloxycyclohexane-1-carboxylate
CID 86642054
methyl 4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexane-1-carboxylate
CID 86282798
benzyl 4-(7-cyclooctylquinoxalin-5-yl)oxycyclohexane-1-carboxylate
CID 139420040
3-[(6-chloropyridazin-3-yl)amino]cyclohexane-1-carboxylic acid
CID 63042065
6-[[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]amino]-N-methylpyridine-3-carboxamide;6-[[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]amino]-N-[(3S)-oxolan-3-yl]pyridine-3-carboxamide;2-N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-N,5-N-diethylpyrimidine-2,5-diamine;8-[4-[[5-(azetidin-1-yl)pyrimidin-2-yl]amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane
CID 159088201
8-[4-[(5-propan-2-yloxypyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine
CID 156673135

Frequently Asked Questions

What is the IUPAC name of 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine?
The IUPAC name of 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine (CID 160648965) is 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine.
What is the SMILES notation for 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine?
The canonical SMILES for 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine is CCOCC.CCOCC.CCOCC.CCOCC.CCOCC.CCOCC.COC(=O)C1CCC(Oc2cc(N)cc3nccnc23)CC1.Cc1cncc(NC2CCC(Oc3cc(N)cc4nccnc34)CC2)n1.Nc1cc(NC2CCC(Oc3ncccn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(C(=O)O)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Nc3ccc(Cl)nn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Oc3ncccn3)CC2)c2nccnc2c1.
What is the InChIKey of 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine?
The InChIKey is RKDYGWWSVUJRBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O.C18H19ClN6O.C18H20N6O.C18H19N5O2.C16H19N3O3.C15H17N3O3.6C4H10O/c1-12-10-21-11-18(24-12)25-14-2-4-15(5-3-14)26-17-9-13(20)8-16-19(17)23-7-6-22-16;19-16-5-6-17(25-24-16)23-12-1-3-13(4-2-12)26-15-10-11(20)9-14-18(15)22-8-7-21-14;2*19-12-10-15-17(21-9-8-20-15)16(11-12)24-13-2-4-14(5-3-13)25-18-22-6-1-7-23-18;1-21-16(20)10-2-4-12(5-3-10)22-14-9-11(17)8-13-15(14)19-7-6-18-13;16-10-7-12-14(18-6-5-17-12)13(8-10)21-11-3-1-9(2-4-11)15(19)20;6*1-3-5-4-2/h6-11,14-15H,2-5,20H2,1H3,(H,24,25);5-10,12-13H,1-4,20H2,(H,23,25);1,6-11,13-14,24H,2-5,19H2;1,6-11,13-14H,2-5,19H2;6-10,12H,2-5,17H2,1H3;5-9,11H,1-4,16H2,(H,19,20);6*3-4H2,1-2H3.
What are the key properties of 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine?
4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine has a molecular weight of 2428.45 g/mol, XLogP of 22.96, 34 rotatable bonds, 10 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylic acid;8-[4-[(6-chloropyridazin-3-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane;methyl 4-(7-aminoquinoxalin-5-yl)oxycyclohexane-1-carboxylate;8-[4-[(6-methylpyrazin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;8-(4-pyrimidin-2-yloxycyclohexyl)oxyquinoxalin-6-amine;5-N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-5,7-diamine is sourced from PubChem (CID 160648965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).