acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole

C63H75Cl9N24O5 — CID 158259393

IUPACacetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole
SMILESCC=O.CCNc1cc(Cl)nc(-n2nc(C)cc2C)c1N.CCNc1cc(Cl)nc(-n2nc(C)cc2C)c1[N+](=O)[O-].CCNc1cc(Cl)nc(Cl)c1.CCNc1cc(Cl)nc(Cl)c1[N+](=O)[O-].CCn1cnc2c(-n3nc(C)cc3C)nc(Cl)cc21.Cc1cc(C)[nH]n1.Nc1cc(Cl)nc(Cl)c1
InChIInChI=1S/C13H14ClN5.C12H14ClN5O2.C12H16ClN5.C7H7Cl2N3O2.C7H8Cl2N2.C5H4Cl2N2.C5H8N2.C2H4O/c1-4-18-7-15-12-10(18)6-11(14)16-13(12)19-9(3)5-8(2)17-19;1-4-14-9-6-10(13)15-12(11(9)18(19)20)17-8(3)5-7(2)16-17;1-4-15-9-6-10(13)16-12(11(9)14)18-8(3)5-7(2)17-18;1-2-10-4-3-5(8)11-7(9)6(4)12(13)14;1-2-10-5-3-6(8)11-7(9)4-5;6-4-1-3(8)2-5(7)9-4;1-4-3-5(2)7-6-4;1-2-3/h5-7H,4H2,1-3H3;5-6H,4H2,1-3H3,(H,14,15);5-6H,4,14H2,1-3H3,(H,15,16);3H,2H2,1H3,(H,10,11);3-4H,2H2,1H3,(H,10,11);1-2H,(H2,8,9);3H,1-2H3,(H,6,7);2H,1H3
InChIKeyGHRQNLGPPJPCRM-UHFFFAOYSA-N
MW1567.53 g/mol
LogP17.09
Rot. Bonds14

About acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole

acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole (PubChem CID 158259393) has the molecular formula C63H75Cl9N24O5 and a molecular weight of 1567.53 g/mol. Its IUPAC name is acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole.

Molecular Properties

Compound Nameacetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole
PubChem CID158259393
Molecular FormulaC63H75Cl9N24O5
Molecular Weight1567.53 g/mol
Exact Mass1562.35
IUPAC Nameacetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole
SMILESCC=O.CCNc1cc(Cl)nc(-n2nc(C)cc2C)c1N.CCNc1cc(Cl)nc(-n2nc(C)cc2C)c1[N+](=O)[O-].CCNc1cc(Cl)nc(Cl)c1.CCNc1cc(Cl)nc(Cl)c1[N+](=O)[O-].CCn1cnc2c(-n3nc(C)cc3C)nc(Cl)cc21.Cc1cc(C)[nH]n1.Nc1cc(Cl)nc(Cl)c1
InChIInChI=1S/C13H14ClN5.C12H14ClN5O2.C12H16ClN5.C7H7Cl2N3O2.C7H8Cl2N2.C5H4Cl2N2.C5H8N2.C2H4O/c1-4-18-7-15-12-10(18)6-11(14)16-13(12)19-9(3)5-8(2)17-19;1-4-14-9-6-10(13)15-12(11(9)18(19)20)17-8(3)5-7(2)16-17;1-4-15-9-6-10(13)16-12(11(9)14)18-8(3)5-7(2)17-18;1-2-10-4-3-5(8)11-7(9)6(4)12(13)14;1-2-10-5-3-6(8)11-7(9)4-5;6-4-1-3(8)2-5(7)9-4;1-4-3-5(2)7-6-4;1-2-3/h5-7H,4H2,1-3H3;5-6H,4H2,1-3H3,(H,14,15);5-6H,4,14H2,1-3H3,(H,15,16);3H,2H2,1H3,(H,10,11);3-4H,2H2,1H3,(H,10,11);1-2H,(H2,8,9);3H,1-2H3,(H,6,7);2H,1H3
InChIKeyGHRQNLGPPJPCRM-UHFFFAOYSA-N
XLogP17.09
TPSA380.81 Ų
H-Bond Donors7
H-Bond Acceptors26
Rotatable Bonds14
Heavy Atoms101
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001567.53
LogP ≤ 517.09
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

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

Analyze acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole with MolForge

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Related Compounds

6-chloro-2-N-(4,4-difluorocyclohexyl)-4-N-methyl-3-nitropyridine-2,4-diamine;N-(4,4-difluorocyclohexyl)-6-(3,5-dimethylpyrazol-1-yl)-1-methylimidazo[4,5-c]pyridin-4-amine;2-N-(4,4-difluorocyclohexyl)-6-(3,5-dimethylpyrazol-1-yl)-4-N-methyl-3-nitropyridine-2,4-diamine;2-N-(4,4-difluorocyclohexyl)-6-(3,5-dimethylpyrazol-1-yl)-4-N-methylpyridine-2,3,4-triamine;3,5-dimethyl-1H-pyrazole
CID 157798765
6-chloro-2-(3,5-dimethylpyrazol-1-yl)-3-nitro-N-propan-2-ylpyridin-4-amine;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-propan-2-ylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-propan-2-ylpyridine-3,4-diamine;2,6-dichloro-3-nitro-N-propan-2-ylpyridin-4-amine;2,6-dichloro-N-propan-2-ylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole;propan-2-one
CID 160395982
2-chloro-N-(1-pyridin-4-ylimidazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-amine;2,4-dichloropyrrolo[2,1-f][1,2,4]triazine;4-iodopyridine;methane;molecular hydrogen;5-nitro-1H-imidazole;4-(4-nitroimidazol-1-yl)pyridine;1-pyridin-4-ylimidazol-4-amine;[(2S)-1-[4-[(1-pyridin-4-ylimidazol-4-yl)amino]pyrrolo[2,1-f][1,2,4]triazin-2-yl]pyrrolidin-2-yl]methanol;[(2S)-pyrrolidin-2-yl]methanol
CID 167603268

Frequently Asked Questions

What is the IUPAC name of acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole?
The IUPAC name of acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole (CID 158259393) is acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole.
What is the SMILES notation for acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole?
The canonical SMILES for acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole is CC=O.CCNc1cc(Cl)nc(-n2nc(C)cc2C)c1N.CCNc1cc(Cl)nc(-n2nc(C)cc2C)c1[N+](=O)[O-].CCNc1cc(Cl)nc(Cl)c1.CCNc1cc(Cl)nc(Cl)c1[N+](=O)[O-].CCn1cnc2c(-n3nc(C)cc3C)nc(Cl)cc21.Cc1cc(C)[nH]n1.Nc1cc(Cl)nc(Cl)c1.
What is the InChIKey of acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole?
The InChIKey is GHRQNLGPPJPCRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN5.C12H14ClN5O2.C12H16ClN5.C7H7Cl2N3O2.C7H8Cl2N2.C5H4Cl2N2.C5H8N2.C2H4O/c1-4-18-7-15-12-10(18)6-11(14)16-13(12)19-9(3)5-8(2)17-19;1-4-14-9-6-10(13)15-12(11(9)18(19)20)17-8(3)5-7(2)16-17;1-4-15-9-6-10(13)16-12(11(9)14)18-8(3)5-7(2)17-18;1-2-10-4-3-5(8)11-7(9)6(4)12(13)14;1-2-10-5-3-6(8)11-7(9)4-5;6-4-1-3(8)2-5(7)9-4;1-4-3-5(2)7-6-4;1-2-3/h5-7H,4H2,1-3H3;5-6H,4H2,1-3H3,(H,14,15);5-6H,4,14H2,1-3H3,(H,15,16);3H,2H2,1H3,(H,10,11);3-4H,2H2,1H3,(H,10,11);1-2H,(H2,8,9);3H,1-2H3,(H,6,7);2H,1H3.
What are the key properties of acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole?
acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole has a molecular weight of 1567.53 g/mol, XLogP of 17.09, 14 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for acetaldehyde;6-chloro-4-(3,5-dimethylpyrazol-1-yl)-1-ethylimidazo[4,5-c]pyridine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-N-ethyl-3-nitropyridin-4-amine;6-chloro-2-(3,5-dimethylpyrazol-1-yl)-4-N-ethylpyridine-3,4-diamine;2,6-dichloro-N-ethyl-3-nitropyridin-4-amine;2,6-dichloro-N-ethylpyridin-4-amine;2,6-dichloropyridin-4-amine;3,5-dimethyl-1H-pyrazole is sourced from PubChem (CID 158259393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).