4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine

C107H134Cl5N15O17S4 — CID 159061014

IUPAC4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine
SMILESCC(C)Oc1cc(CC2CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.CC(C)Oc1cc(SC2=NC=CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.CC(C)Oc1cc(SC2=NN=CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.COCCOc1cc(OC(C)C)c2ccc(OCCN3CCOCC3)c(Cl)c2n1.Cc1nnc(Sc2cc(OC(C)C)c3ccc(OCCN4CCOCC4)c(Cl)c3n2)s1
InChIInChI=1S/C22H26ClN3O3S.C22H29ClN2O3.C21H25ClN4O3S2.C21H25ClN4O3S.C21H29ClN2O5/c1-15(2)29-18-14-20(30-19-4-3-7-24-19)25-22-16(18)5-6-17(21(22)23)28-13-10-26-8-11-27-12-9-26;1-15(2)28-20-14-17(13-16-3-4-16)24-22-18(20)5-6-19(21(22)23)27-12-9-25-7-10-26-11-8-25;1-13(2)29-17-12-18(31-21-25-24-14(3)30-21)23-20-15(17)4-5-16(19(20)22)28-11-8-26-6-9-27-10-7-26;1-14(2)29-17-13-19(30-18-5-6-23-25-18)24-21-15(17)3-4-16(20(21)22)28-12-9-26-7-10-27-11-8-26;1-15(2)29-18-14-19(28-13-12-25-3)23-21-16(18)4-5-17(20(21)22)27-11-8-24-6-9-26-10-7-24/h3,5-7,14-15H,4,8-13H2,1-2H3;5-6,14-16H,3-4,7-13H2,1-2H3;4-5,12-13H,6-11H2,1-3H3;3-4,6,13-14H,5,7-12H2,1-2H3;4-5,14-15H,6-13H2,1-3H3
InChIKeyJYLXMXLGQMFFKT-UHFFFAOYSA-N
MW2207.87 g/mol
LogP21.51
Rot. Bonds40

About 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine

4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine (PubChem CID 159061014) has the molecular formula C107H134Cl5N15O17S4 and a molecular weight of 2207.87 g/mol. Its IUPAC name is 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine.

Molecular Properties

Compound Name4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine
PubChem CID159061014
Molecular FormulaC107H134Cl5N15O17S4
Molecular Weight2207.87 g/mol
Exact Mass2203.74
IUPAC Name4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine
SMILESCC(C)Oc1cc(CC2CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.CC(C)Oc1cc(SC2=NC=CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.CC(C)Oc1cc(SC2=NN=CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.COCCOc1cc(OC(C)C)c2ccc(OCCN3CCOCC3)c(Cl)c2n1.Cc1nnc(Sc2cc(OC(C)C)c3ccc(OCCN4CCOCC4)c(Cl)c3n2)s1
InChIInChI=1S/C22H26ClN3O3S.C22H29ClN2O3.C21H25ClN4O3S2.C21H25ClN4O3S.C21H29ClN2O5/c1-15(2)29-18-14-20(30-19-4-3-7-24-19)25-22-16(18)5-6-17(21(22)23)28-13-10-26-8-11-27-12-9-26;1-15(2)28-20-14-17(13-16-3-4-16)24-22-18(20)5-6-19(21(22)23)27-12-9-25-7-10-26-11-8-25;1-13(2)29-17-12-18(31-21-25-24-14(3)30-21)23-20-15(17)4-5-16(19(20)22)28-11-8-26-6-9-27-10-7-26;1-14(2)29-17-13-19(30-18-5-6-23-25-18)24-21-15(17)3-4-16(20(21)22)28-12-9-26-7-10-27-11-8-26;1-15(2)29-18-14-19(28-13-12-25-3)23-21-16(18)4-5-17(20(21)22)27-11-8-24-6-9-26-10-7-24/h3,5-7,14-15H,4,8-13H2,1-2H3;5-6,14-16H,3-4,7-13H2,1-2H3;4-5,12-13H,6-11H2,1-3H3;3-4,6,13-14H,5,7-12H2,1-2H3;4-5,14-15H,6-13H2,1-3H3
InChIKeyJYLXMXLGQMFFKT-UHFFFAOYSA-N
XLogP21.51
TPSA300.42 Ų
H-Bond Donors
H-Bond Acceptors36
Rotatable Bonds40
Heavy Atoms148
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002207.87
LogP ≤ 521.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

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

Analyze 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine?
The IUPAC name of 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine (CID 159061014) is 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine.
What is the SMILES notation for 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine?
The canonical SMILES for 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine is CC(C)Oc1cc(CC2CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.CC(C)Oc1cc(SC2=NC=CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.CC(C)Oc1cc(SC2=NN=CC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.COCCOc1cc(OC(C)C)c2ccc(OCCN3CCOCC3)c(Cl)c2n1.Cc1nnc(Sc2cc(OC(C)C)c3ccc(OCCN4CCOCC4)c(Cl)c3n2)s1.
What is the InChIKey of 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine?
The InChIKey is JYLXMXLGQMFFKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26ClN3O3S.C22H29ClN2O3.C21H25ClN4O3S2.C21H25ClN4O3S.C21H29ClN2O5/c1-15(2)29-18-14-20(30-19-4-3-7-24-19)25-22-16(18)5-6-17(21(22)23)28-13-10-26-8-11-27-12-9-26;1-15(2)28-20-14-17(13-16-3-4-16)24-22-18(20)5-6-19(21(22)23)27-12-9-25-7-10-26-11-8-25;1-13(2)29-17-12-18(31-21-25-24-14(3)30-21)23-20-15(17)4-5-16(19(20)22)28-11-8-26-6-9-27-10-7-26;1-14(2)29-17-13-19(30-18-5-6-23-25-18)24-21-15(17)3-4-16(20(21)22)28-12-9-26-7-10-27-11-8-26;1-15(2)29-18-14-19(28-13-12-25-3)23-21-16(18)4-5-17(20(21)22)27-11-8-24-6-9-26-10-7-24/h3,5-7,14-15H,4,8-13H2,1-2H3;5-6,14-16H,3-4,7-13H2,1-2H3;4-5,12-13H,6-11H2,1-3H3;3-4,6,13-14H,5,7-12H2,1-2H3;4-5,14-15H,6-13H2,1-3H3.
What are the key properties of 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine?
4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine has a molecular weight of 2207.87 g/mol, XLogP of 21.51, 40 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[8-chloro-2-(cyclopropylmethyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methoxyethoxy)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(4H-pyrazol-3-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine;4-[2-[8-chloro-4-propan-2-yloxy-2-(3H-pyrrol-2-ylsulfanyl)quinolin-7-yl]oxyethyl]morpholine is sourced from PubChem (CID 159061014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).