7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane

C92H105Cl7N16O9 — CID 160846852

IUPAC7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane
SMILESC.C.CCN(CC)CCOc1ccc(N)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(-c2c(Cl)cccc2OC)c(=O)n3CC)nc1.CCNc1cc(Cl)ncc1C=O.CCn1c(=O)c(-c2c(Cl)cccc2OC)cc2cnc(Cl)cc21.COc1cccc(Cl)c1CC#N.[H]/N=c1/c(-c2c(Cl)cccc2OC)cc2cnc(Cl)cc2n1CC
InChIInChI=1S/C28H32ClN5O3.C17H15Cl2N3O.C17H14Cl2N2O2.C11H19N3O.C9H8ClNO.C8H9ClN2O.2CH4/c1-5-33(6-2)13-14-37-20-11-12-25(31-18-20)32-26-16-23-19(17-30-26)15-21(28(35)34(23)7-3)27-22(29)9-8-10-24(27)36-4;1-3-22-13-8-15(19)21-9-10(13)7-11(17(22)20)16-12(18)5-4-6-14(16)23-2;1-3-21-13-8-15(19)20-9-10(13)7-11(17(21)22)16-12(18)5-4-6-14(16)23-2;1-3-14(4-2)7-8-15-10-5-6-11(12)13-9-10;1-12-9-4-2-3-8(10)7(9)5-6-11;1-2-10-7-3-8(9)11-4-6(7)5-12;;/h8-12,15-18H,5-7,13-14H2,1-4H3,(H,30,31,32);4-9,20H,3H2,1-2H3;4-9H,3H2,1-2H3;5-6,9H,3-4,7-8H2,1-2H3,(H2,12,13);2-4H,5H2,1H3;3-5H,2H2,1H3,(H,10,11);2*1H4/b;20-17-;;;;;;
InChIKeySITDOAJDBBBXFV-PHIMNKEBSA-N
MW1827.13 g/mol
LogP21.57
Rot. Bonds28

About 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane

7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane (PubChem CID 160846852) has the molecular formula C92H105Cl7N16O9 and a molecular weight of 1827.13 g/mol. Its IUPAC name is 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane.

Molecular Properties

Compound Name7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane
PubChem CID160846852
Molecular FormulaC92H105Cl7N16O9
Molecular Weight1827.13 g/mol
Exact Mass1822.61
IUPAC Name7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane
SMILESC.C.CCN(CC)CCOc1ccc(N)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(-c2c(Cl)cccc2OC)c(=O)n3CC)nc1.CCNc1cc(Cl)ncc1C=O.CCn1c(=O)c(-c2c(Cl)cccc2OC)cc2cnc(Cl)cc21.COc1cccc(Cl)c1CC#N.[H]/N=c1/c(-c2c(Cl)cccc2OC)cc2cnc(Cl)cc2n1CC
InChIInChI=1S/C28H32ClN5O3.C17H15Cl2N3O.C17H14Cl2N2O2.C11H19N3O.C9H8ClNO.C8H9ClN2O.2CH4/c1-5-33(6-2)13-14-37-20-11-12-25(31-18-20)32-26-16-23-19(17-30-26)15-21(28(35)34(23)7-3)27-22(29)9-8-10-24(27)36-4;1-3-22-13-8-15(19)21-9-10(13)7-11(17(22)20)16-12(18)5-4-6-14(16)23-2;1-3-21-13-8-15(19)20-9-10(13)7-11(17(21)22)16-12(18)5-4-6-14(16)23-2;1-3-14(4-2)7-8-15-10-5-6-11(12)13-9-10;1-12-9-4-2-3-8(10)7(9)5-6-11;1-2-10-7-3-8(9)11-4-6(7)5-12;;/h8-12,15-18H,5-7,13-14H2,1-4H3,(H,30,31,32);4-9,20H,3H2,1-2H3;4-9H,3H2,1-2H3;5-6,9H,3-4,7-8H2,1-2H3,(H2,12,13);2-4H,5H2,1H3;3-5H,2H2,1H3,(H,10,11);2*1H4/b;20-17-;;;;;;
InChIKeySITDOAJDBBBXFV-PHIMNKEBSA-N
XLogP21.57
TPSA302.92 Ų
H-Bond Donors4
H-Bond Acceptors25
Rotatable Bonds28
Heavy Atoms124
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001827.13
LogP ≤ 521.57
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane with MolForge

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Related Compounds

7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-(2,6-difluorophenyl)-1-ethyl-1,6-naphthyridin-2-one
CID 118400017
3-(2,6-dichlorophenyl)-7-[4-[2-(diethylamino)ethoxy]anilino]-1-ethyl-1,6-naphthyridin-2-one
CID 22124644
3-(3-chloro-2,6-difluorophenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one
CID 118400021
3-(2-chloro-6-methoxyphenyl)-7-[[(1Z,3E)-4-[2-(diethylamino)ethoxy]-1-(methylideneamino)penta-1,3-dienyl]amino]-1-ethyl-1,6-naphthyridin-2-one
CID 129047472
7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-(2-fluoro-4-methylphenyl)-1,6-naphthyridin-2-one
CID 122691284
3-(2-chlorophenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;3-(2,6-dichlorophenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-(2,6-difluoro-4-methylphenyl)-1-ethyl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-(2,4-dimethylphenyl)-1-ethyl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-(2-fluoro-4-methylphenyl)-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-(3-methylsulfanylphenyl)-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-(4-methylsulfanylphenyl)-1,6-naphthyridin-2-one
CID 160540853
3-(2,6-dichlorophenyl)-7-[4-[3-(diethylamino)propoxy]anilino]-1-methyl-1,6-naphthyridin-2-one
CID 5328717
7-[4-[2-(diethylamino)ethoxy]anilino]-1-ethyl-3-thiophen-2-yl-1,6-naphthyridin-2-one
CID 22124700
bis(1-cyclopentyl-3-(2,6-dichlorophenyl)-7-[(5-fluoro-2-pyridinyl)amino]-1,6-naphthyridin-2-one);1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-(2,6-difluorophenyl)-1,6-naphthyridin-2-one;bis(3-(2,6-dichlorophenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-(oxolan-3-yl)-1,6-naphthyridin-2-one)
CID 157182867
4-amino-6-chloropyridine-3-carbaldehyde;(4-amino-6-chloro-3-pyridinyl)methanol;7-chloro-1-phenyl-3-propan-2-yl-1,6-naphthyridin-2-one;7-chloro-3-propan-2-yl-1H-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-phenyl-3-propan-2-yl-1,6-naphthyridin-2-one;(2,4-dimethoxyphenyl)methanamine;dioxomanganese;ethyl 4-amino-6-chloropyridine-3-carboxylate;ethyl 6-chloro-4-[(2,4-dimethoxyphenyl)methylamino]pyridine-3-carboxylate;ethyl 4,6-dichloropyridine-3-carboxylate;methyl 3-methylbutanoate;phenylboronic acid
CID 157156354
3-(2,6-difluorophenyl)-1-ethyl-7-[(5-fluoro-2-pyridinyl)amino]-1,6-naphthyridin-2-one
CID 118400003
7-[4-(diethylamino)butylamino]-3-(3,5-dimethoxy-2,6-dimethylphenyl)-1-ethyl-1,6-naphthyridin-2-one
CID 22124658

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane?
The IUPAC name of 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane (CID 160846852) is 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane.
What is the SMILES notation for 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane?
The canonical SMILES for 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane is C.C.CCN(CC)CCOc1ccc(N)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(-c2c(Cl)cccc2OC)c(=O)n3CC)nc1.CCNc1cc(Cl)ncc1C=O.CCn1c(=O)c(-c2c(Cl)cccc2OC)cc2cnc(Cl)cc21.COc1cccc(Cl)c1CC#N.[H]/N=c1/c(-c2c(Cl)cccc2OC)cc2cnc(Cl)cc2n1CC.
What is the InChIKey of 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane?
The InChIKey is SITDOAJDBBBXFV-PHIMNKEBSA-N. The full InChI is InChI=1S/C28H32ClN5O3.C17H15Cl2N3O.C17H14Cl2N2O2.C11H19N3O.C9H8ClNO.C8H9ClN2O.2CH4/c1-5-33(6-2)13-14-37-20-11-12-25(31-18-20)32-26-16-23-19(17-30-26)15-21(28(35)34(23)7-3)27-22(29)9-8-10-24(27)36-4;1-3-22-13-8-15(19)21-9-10(13)7-11(17(22)20)16-12(18)5-4-6-14(16)23-2;1-3-21-13-8-15(19)20-9-10(13)7-11(17(21)22)16-12(18)5-4-6-14(16)23-2;1-3-14(4-2)7-8-15-10-5-6-11(12)13-9-10;1-12-9-4-2-3-8(10)7(9)5-6-11;1-2-10-7-3-8(9)11-4-6(7)5-12;;/h8-12,15-18H,5-7,13-14H2,1-4H3,(H,30,31,32);4-9,20H,3H2,1-2H3;4-9H,3H2,1-2H3;5-6,9H,3-4,7-8H2,1-2H3,(H2,12,13);2-4H,5H2,1H3;3-5H,2H2,1H3,(H,10,11);2*1H4/b;20-17-;;;;;;.
What are the key properties of 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane?
7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane has a molecular weight of 1827.13 g/mol, XLogP of 21.57, 28 rotatable bonds, 4 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-imine;7-chloro-3-(2-chloro-6-methoxyphenyl)-1-ethyl-1,6-naphthyridin-2-one;6-chloro-4-(ethylamino)pyridine-3-carbaldehyde;2-(2-chloro-6-methoxyphenyl)acetonitrile;3-(2-chloro-6-methoxyphenyl)-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;methane is sourced from PubChem (CID 160846852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).