dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate

C81H81Cl2K2N15O10 — CID 159263278

IUPACdipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate
SMILESCCN(CC)CCOc1ccc(N)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(-c2ccccc2)c(=O)n3-c2ccncc2)nc1.COC(=O)Cc1ccccc1.O=CO[O-].O=Cc1cnc(Cl)cc1Nc1ccncc1.O=c1c(-c2ccccc2)cc2cnc(Cl)cc2n1-c1ccncc1.[H-].[K+].[K+]
InChIInChI=1S/C30H30N6O2.C19H12ClN3O.C11H8ClN3O.C11H19N3O.C9H10O2.CH2O3.2K.H/c1-3-35(4-2)16-17-38-25-10-11-28(33-21-25)34-29-19-27-23(20-32-29)18-26(22-8-6-5-7-9-22)30(37)36(27)24-12-14-31-15-13-24;20-18-11-17-14(12-22-18)10-16(13-4-2-1-3-5-13)19(24)23(17)15-6-8-21-9-7-15;12-11-5-10(8(7-16)6-14-11)15-9-1-3-13-4-2-9;1-3-14(4-2)7-8-15-10-5-6-11(12)13-9-10;1-11-9(10)7-8-5-3-2-4-6-8;2-1-4-3;;;/h5-15,18-21H,3-4,16-17H2,1-2H3,(H,32,33,34);1-12H;1-7H,(H,13,14,15);5-6,9H,3-4,7-8H2,1-2H3,(H2,12,13);2-6H,7H2,1H3;1,3H;;;/q;;;;;;2*+1;-1/p-1
InChIKeyNGPNMUNXFLLOPE-UHFFFAOYSA-M
MW1573.74 g/mol
LogP7.44
Rot. Bonds24

About dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate

dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate (PubChem CID 159263278) has the molecular formula C81H81Cl2K2N15O10 and a molecular weight of 1573.74 g/mol. Its IUPAC name is dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate.

Molecular Properties

Compound Namedipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate
PubChem CID159263278
Molecular FormulaC81H81Cl2K2N15O10
Molecular Weight1573.74 g/mol
Exact Mass1571.49
IUPAC Namedipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate
SMILESCCN(CC)CCOc1ccc(N)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(-c2ccccc2)c(=O)n3-c2ccncc2)nc1.COC(=O)Cc1ccccc1.O=CO[O-].O=Cc1cnc(Cl)cc1Nc1ccncc1.O=c1c(-c2ccccc2)cc2cnc(Cl)cc2n1-c1ccncc1.[H-].[K+].[K+]
InChIInChI=1S/C30H30N6O2.C19H12ClN3O.C11H8ClN3O.C11H19N3O.C9H10O2.CH2O3.2K.H/c1-3-35(4-2)16-17-38-25-10-11-28(33-21-25)34-29-19-27-23(20-32-29)18-26(22-8-6-5-7-9-22)30(37)36(27)24-12-14-31-15-13-24;20-18-11-17-14(12-22-18)10-16(13-4-2-1-3-5-13)19(24)23(17)15-6-8-21-9-7-15;12-11-5-10(8(7-16)6-14-11)15-9-1-3-13-4-2-9;1-3-14(4-2)7-8-15-10-5-6-11(12)13-9-10;1-11-9(10)7-8-5-3-2-4-6-8;2-1-4-3;;;/h5-15,18-21H,3-4,16-17H2,1-2H3,(H,32,33,34);1-12H;1-7H,(H,13,14,15);5-6,9H,3-4,7-8H2,1-2H3,(H2,12,13);2-6H,7H2,1H3;1,3H;;;/q;;;;;;2*+1;-1/p-1
InChIKeyNGPNMUNXFLLOPE-UHFFFAOYSA-M
XLogP7.44
TPSA314.87 Ų
H-Bond Donors3
H-Bond Acceptors25
Rotatable Bonds24
Heavy Atoms110
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001573.74
LogP ≤ 57.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate with MolForge

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Related Compounds

N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-2-pyridinyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide
CID 159101247
4-amino-6-chloropyridine-3-carbaldehyde;(4-amino-6-chloro-3-pyridinyl)methanol;7-chloro-3-phenyl-1H-1,6-naphthyridin-2-one;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1H-1,6-naphthyridin-2-one;(2,4-dimethoxyphenyl)methanamine;ethyl 4-amino-6-chloropyridine-3-carboxylate;ethyl 6-chloro-4-[(2,4-dimethoxyphenyl)methylamino]pyridine-3-carboxylate;ethyl 4,6-dichloropyridine-3-carboxylate;ethyl 2-phenylacetate;methane;2,2,2-trifluoroacetaldehyde
CID 160351090
Tert-butyl 6-(5-chloro-2-fluorophenyl)-8-[[3-[(1-methylpiperidin-4-yl)carbamoyl]-4-pyridinyl]amino]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxylate
CID 162441503
Tert-butyl 6-(5-chloro-2-fluorophenyl)-8-[[3-[2-(4-methylpiperazin-1-yl)ethylcarbamoyl]-4-pyridinyl]amino]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxylate
CID 162441525
tert-butyl 4-[2-[[4-[[6-(5-chloro-2-fluorophenyl)-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-8-yl]amino]pyridine-3-carbonyl]amino]ethyl]piperazine-1-carboxylate
CID 162441551
Tert-butyl 8-[[3-[2-(4-acetylpiperazin-1-yl)ethylcarbamoyl]-4-pyridinyl]amino]-6-(5-chloro-2-fluorophenyl)-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxylate
CID 162441581
Tert-butyl 6-(5-chloro-2-fluorophenyl)-8-[[3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]carbamoyl]-4-pyridinyl]amino]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxylate
CID 162441593
N-[6-chloro-4-[methyl(pyrimidin-5-yl)amino]-2-pyridinyl]-3-methylbenzamide;3-methyl-N-[5-[methyl(pyridin-3-yl)amino]-3-pyridinyl]benzamide;3-methyl-N-[2-[methyl(pyrimidin-5-yl)amino]-4-pyridinyl]benzamide;3-methyl-N-(5-pyridin-3-yloxy-3-pyridinyl)benzamide
CID 123923948
Ethyl 6-ethoxy-4-(6-ethoxy-2-pyridylamino)-7-methyl-1,8-naphthyridine-3-carboxylate sesquihydrochloride hydrate
CID 131720767
3-[4-[(3,5-dichloro-4-pyridinyl)carbamoyl]-N-(3-phenylmethoxy-2-pyridinyl)anilino]propanoic acid
CID 140431757
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-Butyl-5-[(4-chlorophenyl)-hydroxymethyl]-1-methyl-6-[(6-methyl-3-pyridinyl)oxy]pyrido[2,3-d]pyrimidine-2,4-dione;3-butyl-1-methyl-6-[(6-methyl-3-pyridinyl)oxy]pyrido[2,3-d]pyrimidine-2,4-dione;4-chlorobenzaldehyde
CID 157200797

Frequently Asked Questions

What is the IUPAC name of dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate?
The IUPAC name of dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate (CID 159263278) is dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate.
What is the SMILES notation for dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate?
The canonical SMILES for dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate is CCN(CC)CCOc1ccc(N)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(-c2ccccc2)c(=O)n3-c2ccncc2)nc1.COC(=O)Cc1ccccc1.O=CO[O-].O=Cc1cnc(Cl)cc1Nc1ccncc1.O=c1c(-c2ccccc2)cc2cnc(Cl)cc2n1-c1ccncc1.[H-].[K+].[K+].
What is the InChIKey of dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate?
The InChIKey is NGPNMUNXFLLOPE-UHFFFAOYSA-M. The full InChI is InChI=1S/C30H30N6O2.C19H12ClN3O.C11H8ClN3O.C11H19N3O.C9H10O2.CH2O3.2K.H/c1-3-35(4-2)16-17-38-25-10-11-28(33-21-25)34-29-19-27-23(20-32-29)18-26(22-8-6-5-7-9-22)30(37)36(27)24-12-14-31-15-13-24;20-18-11-17-14(12-22-18)10-16(13-4-2-1-3-5-13)19(24)23(17)15-6-8-21-9-7-15;12-11-5-10(8(7-16)6-14-11)15-9-1-3-13-4-2-9;1-3-14(4-2)7-8-15-10-5-6-11(12)13-9-10;1-11-9(10)7-8-5-3-2-4-6-8;2-1-4-3;;;/h5-15,18-21H,3-4,16-17H2,1-2H3,(H,32,33,34);1-12H;1-7H,(H,13,14,15);5-6,9H,3-4,7-8H2,1-2H3,(H2,12,13);2-6H,7H2,1H3;1,3H;;;/q;;;;;;2*+1;-1/p-1.
What are the key properties of dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate?
dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate has a molecular weight of 1573.74 g/mol, XLogP of 7.44, 24 rotatable bonds, 3 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;7-chloro-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;6-chloro-4-(pyridin-4-ylamino)pyridine-3-carbaldehyde;5-[2-(diethylamino)ethoxy]pyridin-2-amine;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-phenyl-1-pyridin-4-yl-1,6-naphthyridin-2-one;hydride;methyl 2-phenylacetate;oxido formate is sourced from PubChem (CID 159263278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).