2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol

C72H81Cl2F3N24O9 — CID 157495730

IUPAC2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
SMILESCNc1nc(Cl)ncc1C(F)(F)F.Cc1[nH]ncc1[N+](=O)[O-].Cc1nn(C2CCCn3ccnc32)cc1N.Cc1nn(C2CCCn3ccnc32)cc1[N+](=O)[O-].Nc1ncccc1O.Nc1ncccc1OCc1ccccc1.O=CCCl.OC1CCCn2ccnc21.c1ccc(COc2cccn3ccnc23)cc1
InChIInChI=1S/C14H12N2O.C12H12N2O.C11H13N5O2.C11H15N5.C7H10N2O.C6H5ClF3N3.C5H6N2O.C4H5N3O2.C2H3ClO/c1-2-5-12(6-3-1)11-17-13-7-4-9-16-10-8-15-14(13)16;13-12-11(7-4-8-14-12)15-9-10-5-2-1-3-6-10;1-8-10(16(17)18)7-15(13-8)9-3-2-5-14-6-4-12-11(9)14;1-8-9(12)7-16(14-8)10-3-2-5-15-6-4-13-11(10)15;10-6-2-1-4-9-5-3-8-7(6)9;1-11-4-3(6(8,9)10)2-12-5(7)13-4;6-5-4(8)2-1-3-7-5;1-3-4(7(8)9)2-5-6-3;3-1-2-4/h1-10H,11H2;1-8H,9H2,(H2,13,14);4,6-7,9H,2-3,5H2,1H3;4,6-7,10H,2-3,5,12H2,1H3;3,5-6,10H,1-2,4H2;2H,1H3,(H,11,12,13);1-3,8H,(H2,6,7);2H,1H3,(H,5,6);2H,1H2
InChIKeyBXUTXCLDSKFXDL-UHFFFAOYSA-N
MW1554.50 g/mol
LogP12.51
Rot. Bonds12

About 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol

2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol (PubChem CID 157495730) has the molecular formula C72H81Cl2F3N24O9 and a molecular weight of 1554.50 g/mol. Its IUPAC name is 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol.

Molecular Properties

Compound Name2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
PubChem CID157495730
Molecular FormulaC72H81Cl2F3N24O9
Molecular Weight1554.50 g/mol
Exact Mass1552.59
IUPAC Name2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol
SMILESCNc1nc(Cl)ncc1C(F)(F)F.Cc1[nH]ncc1[N+](=O)[O-].Cc1nn(C2CCCn3ccnc32)cc1N.Cc1nn(C2CCCn3ccnc32)cc1[N+](=O)[O-].Nc1ncccc1O.Nc1ncccc1OCc1ccccc1.O=CCCl.OC1CCCn2ccnc21.c1ccc(COc2cccn3ccnc23)cc1
InChIInChI=1S/C14H12N2O.C12H12N2O.C11H13N5O2.C11H15N5.C7H10N2O.C6H5ClF3N3.C5H6N2O.C4H5N3O2.C2H3ClO/c1-2-5-12(6-3-1)11-17-13-7-4-9-16-10-8-15-14(13)16;13-12-11(7-4-8-14-12)15-9-10-5-2-1-3-6-10;1-8-10(16(17)18)7-15(13-8)9-3-2-5-14-6-4-12-11(9)14;1-8-9(12)7-16(14-8)10-3-2-5-15-6-4-13-11(10)15;10-6-2-1-4-9-5-3-8-7(6)9;1-11-4-3(6(8,9)10)2-12-5(7)13-4;6-5-4(8)2-1-3-7-5;1-3-4(7(8)9)2-5-6-3;3-1-2-4/h1-10H,11H2;1-8H,9H2,(H2,13,14);4,6-7,9H,2-3,5H2,1H3;4,6-7,10H,2-3,5,12H2,1H3;3,5-6,10H,1-2,4H2;2H,1H3,(H,11,12,13);1-3,8H,(H2,6,7);2H,1H3,(H,5,6);2H,1H2
InChIKeyBXUTXCLDSKFXDL-UHFFFAOYSA-N
XLogP12.51
TPSA439.00 Ų
H-Bond Donors7
H-Bond Acceptors30
Rotatable Bonds12
Heavy Atoms110
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001554.50
LogP ≤ 512.51
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_C(3)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol with MolForge

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Related Compounds

2-[6-(benzylamino)-2-fluoropurin-9-yl]ethanol;N-benzyl-2-chloro-7H-purin-6-amine;6-N-benzyl-4-N-(1,5-dimethylpyrazol-3-yl)-4-N,1-dimethylpyrazolo[5,4-d]pyrimidine-4,6-diamine;6-N-benzyl-4-N-(1,5-dimethylpyrazol-3-yl)-6-N,1-dimethylpyrazolo[3,4-d]pyrimidine-4,6-diamine;N-benzyl-2-fluoro-9-propan-2-ylpurin-6-amine;N-benzyl-9-methyl-2-nitropurin-6-amine;N-benzyl-9-methylpurin-6-amine;2-fluoro-9-methyl-6-phenylmethoxypurine
CID 157320925
2-[(1-cyclohexylpyrazol-4-yl)methyl]-5-(1-methylpyrazol-4-yl)-N-propan-2-ylpyrrolo[3,2-d]pyrimidin-4-amine;2-[[1-(2-fluoroethyl)pyrazol-4-yl]methyl]-5-(1-methylpyrazol-4-yl)-4-[(3S)-oxolan-3-yl]oxypyrrolo[3,2-d]pyrimidine;5-(1-methylpyrazol-4-yl)-2-[(1-methylpyrazol-4-yl)methyl]-4-[(3S)-oxolan-3-yl]oxypyrrolo[3,2-d]pyrimidine;4-[[5-(1-methylpyrazol-4-yl)-2-[(1-methylpyrazol-4-yl)methyl]pyrrolo[3,2-d]pyrimidin-4-yl]amino]cyclohexan-1-ol;5-(1-methylpyrazol-4-yl)-2-[[1-(oxan-4-yl)pyrazol-4-yl]methyl]-N-propan-2-ylpyrrolo[3,2-d]pyrimidin-4-amine;5-(1-methylpyrazol-4-yl)-4-[(3S)-oxolan-3-yl]oxy-2-(1H-pyrazol-4-ylmethyl)pyrrolo[3,2-d]pyrimidine
CID 159930355
tris(carbon dioxide);2-chloro-5-ethyl-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;2,6-dimethylpyridine;bis(5-ethyl-N-(3-fluoro-4-pyridinyl)-2-(6-methyl-2-pyridinyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine);5-ethyl-2-(6-methyl-2-pyridinyl)-4-phenoxypyrrolo[2,1-f][1,2,4]triazine;3-fluoropyridin-4-amine;[4-[(3-fluoro-4-pyridinyl)amino]-2-(6-methyl-2-pyridinyl)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methanol;(3S)-pyrrolidin-3-ol
CID 160193610
bis([3-[6-(cyclopentylamino)-2-pyridinyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol);N-cyclopentyl-3,5-difluoro-6-[7-methyl-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;N-cyclopentyl-6-(6,7-dimethylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine;N-cyclopentyl-6-[8-methoxy-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine;3-(6-cyclopentyloxy-2-pyridinyl)-7-methyl-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine
CID 167572256

Frequently Asked Questions

What is the IUPAC name of 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The IUPAC name of 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol (CID 157495730) is 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol.
What is the SMILES notation for 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The canonical SMILES for 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol is CNc1nc(Cl)ncc1C(F)(F)F.Cc1[nH]ncc1[N+](=O)[O-].Cc1nn(C2CCCn3ccnc32)cc1N.Cc1nn(C2CCCn3ccnc32)cc1[N+](=O)[O-].Nc1ncccc1O.Nc1ncccc1OCc1ccccc1.O=CCCl.OC1CCCn2ccnc21.c1ccc(COc2cccn3ccnc23)cc1.
What is the InChIKey of 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
The InChIKey is BXUTXCLDSKFXDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O.C12H12N2O.C11H13N5O2.C11H15N5.C7H10N2O.C6H5ClF3N3.C5H6N2O.C4H5N3O2.C2H3ClO/c1-2-5-12(6-3-1)11-17-13-7-4-9-16-10-8-15-14(13)16;13-12-11(7-4-8-14-12)15-9-10-5-2-1-3-6-10;1-8-10(16(17)18)7-15(13-8)9-3-2-5-14-6-4-12-11(9)14;1-8-9(12)7-16(14-8)10-3-2-5-15-6-4-13-11(10)15;10-6-2-1-4-9-5-3-8-7(6)9;1-11-4-3(6(8,9)10)2-12-5(7)13-4;6-5-4(8)2-1-3-7-5;1-3-4(7(8)9)2-5-6-3;3-1-2-4/h1-10H,11H2;1-8H,9H2,(H2,13,14);4,6-7,9H,2-3,5H2,1H3;4,6-7,10H,2-3,5,12H2,1H3;3,5-6,10H,1-2,4H2;2H,1H3,(H,11,12,13);1-3,8H,(H2,6,7);2H,1H3,(H,5,6);2H,1H2.
What are the key properties of 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol?
2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol has a molecular weight of 1554.50 g/mol, XLogP of 12.51, 12 rotatable bonds, 7 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopyridin-3-ol;2-chloroacetaldehyde;2-chloro-N-methyl-5-(trifluoromethyl)pyrimidin-4-amine;5-methyl-4-nitro-1H-pyrazole;8-(3-methyl-4-nitropyrazol-1-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-methyl-1-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)pyrazol-4-amine;8-phenylmethoxyimidazo[1,2-a]pyridine;3-phenylmethoxypyridin-2-amine;5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ol is sourced from PubChem (CID 157495730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).