4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine

C125H147N19O9 — CID 160526580

IUPAC4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine
SMILESCCC(CC)c1nc2ccccn2c1NC1CCCCC1.COc1cc(-c2nc3ccccn3c2NC2CCCCC2)cc(OC)c1O.COc1ccc(-c2nc3ccccn3c2NC2CCCCC2)cc1OC.O=[N+]([O-])c1ccc(-c2nc3ccccn3c2NC2CCCCC2)cc1.Oc1ccccc1-c1nc2ccccn2c1NC1CCCCC1.c1ccc(COc2ccc(Cc3nc4ccccn4c3NC3CCCCC3)cc2)cc1
InChIInChI=1S/C27H29N3O.C21H25N3O3.C21H25N3O2.C19H20N4O2.C19H21N3O.C18H27N3/c1-3-9-22(10-4-1)20-31-24-16-14-21(15-17-24)19-25-27(28-23-11-5-2-6-12-23)30-18-8-7-13-26(30)29-25;1-26-16-12-14(13-17(27-2)20(16)25)19-21(22-15-8-4-3-5-9-15)24-11-7-6-10-18(24)23-19;1-25-17-12-11-15(14-18(17)26-2)20-21(22-16-8-4-3-5-9-16)24-13-7-6-10-19(24)23-20;24-23(25)16-11-9-14(10-12-16)18-19(20-15-6-2-1-3-7-15)22-13-5-4-8-17(22)21-18;23-16-11-5-4-10-15(16)18-19(20-14-8-2-1-3-9-14)22-13-7-6-12-17(22)21-18;1-3-14(4-2)17-18(19-15-10-6-5-7-11-15)21-13-9-8-12-16(21)20-17/h1,3-4,7-10,13-18,23,28H,2,5-6,11-12,19-20H2;6-7,10-13,15,22,25H,3-5,8-9H2,1-2H3;6-7,10-14,16,22H,3-5,8-9H2,1-2H3;4-5,8-13,15,20H,1-3,6-7H2;4-7,10-14,20,23H,1-3,8-9H2;8-9,12-15,19H,3-7,10-11H2,1-2H3
InChIKeyQUZCCCUOGYEUFN-UHFFFAOYSA-N
MW2059.67 g/mol
LogP29.57
Rot. Bonds29

About 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine

4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine (PubChem CID 160526580) has the molecular formula C125H147N19O9 and a molecular weight of 2059.67 g/mol. Its IUPAC name is 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine
PubChem CID160526580
Molecular FormulaC125H147N19O9
Molecular Weight2059.67 g/mol
Exact Mass2058.16
IUPAC Name4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine
SMILESCCC(CC)c1nc2ccccn2c1NC1CCCCC1.COc1cc(-c2nc3ccccn3c2NC2CCCCC2)cc(OC)c1O.COc1ccc(-c2nc3ccccn3c2NC2CCCCC2)cc1OC.O=[N+]([O-])c1ccc(-c2nc3ccccn3c2NC2CCCCC2)cc1.Oc1ccccc1-c1nc2ccccn2c1NC1CCCCC1.c1ccc(COc2ccc(Cc3nc4ccccn4c3NC3CCCCC3)cc2)cc1
InChIInChI=1S/C27H29N3O.C21H25N3O3.C21H25N3O2.C19H20N4O2.C19H21N3O.C18H27N3/c1-3-9-22(10-4-1)20-31-24-16-14-21(15-17-24)19-25-27(28-23-11-5-2-6-12-23)30-18-8-7-13-26(30)29-25;1-26-16-12-14(13-17(27-2)20(16)25)19-21(22-15-8-4-3-5-9-15)24-11-7-6-10-18(24)23-19;1-25-17-12-11-15(14-18(17)26-2)20-21(22-16-8-4-3-5-9-16)24-13-7-6-10-19(24)23-20;24-23(25)16-11-9-14(10-12-16)18-19(20-15-6-2-1-3-7-15)22-13-5-4-8-17(22)21-18;23-16-11-5-4-10-15(16)18-19(20-14-8-2-1-3-9-14)22-13-7-6-12-17(22)21-18;1-3-14(4-2)17-18(19-15-10-6-5-7-11-15)21-13-9-8-12-16(21)20-17/h1,3-4,7-10,13-18,23,28H,2,5-6,11-12,19-20H2;6-7,10-13,15,22,25H,3-5,8-9H2,1-2H3;6-7,10-14,16,22H,3-5,8-9H2,1-2H3;4-5,8-13,15,20H,1-3,6-7H2;4-7,10-14,20,23H,1-3,8-9H2;8-9,12-15,19H,3-7,10-11H2,1-2H3
InChIKeyQUZCCCUOGYEUFN-UHFFFAOYSA-N
XLogP29.57
TPSA305.73 Ų
H-Bond Donors8
H-Bond Acceptors27
Rotatable Bonds29
Heavy Atoms153
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002059.67
LogP ≤ 529.57
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

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

Analyze 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine (CID 160526580) is 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine is CCC(CC)c1nc2ccccn2c1NC1CCCCC1.COc1cc(-c2nc3ccccn3c2NC2CCCCC2)cc(OC)c1O.COc1ccc(-c2nc3ccccn3c2NC2CCCCC2)cc1OC.O=[N+]([O-])c1ccc(-c2nc3ccccn3c2NC2CCCCC2)cc1.Oc1ccccc1-c1nc2ccccn2c1NC1CCCCC1.c1ccc(COc2ccc(Cc3nc4ccccn4c3NC3CCCCC3)cc2)cc1.
What is the InChIKey of 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine?
The InChIKey is QUZCCCUOGYEUFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N3O.C21H25N3O3.C21H25N3O2.C19H20N4O2.C19H21N3O.C18H27N3/c1-3-9-22(10-4-1)20-31-24-16-14-21(15-17-24)19-25-27(28-23-11-5-2-6-12-23)30-18-8-7-13-26(30)29-25;1-26-16-12-14(13-17(27-2)20(16)25)19-21(22-15-8-4-3-5-9-15)24-11-7-6-10-18(24)23-19;1-25-17-12-11-15(14-18(17)26-2)20-21(22-16-8-4-3-5-9-16)24-13-7-6-10-19(24)23-20;24-23(25)16-11-9-14(10-12-16)18-19(20-15-6-2-1-3-7-15)22-13-5-4-8-17(22)21-18;23-16-11-5-4-10-15(16)18-19(20-14-8-2-1-3-9-14)22-13-7-6-12-17(22)21-18;1-3-14(4-2)17-18(19-15-10-6-5-7-11-15)21-13-9-8-12-16(21)20-17/h1,3-4,7-10,13-18,23,28H,2,5-6,11-12,19-20H2;6-7,10-13,15,22,25H,3-5,8-9H2,1-2H3;6-7,10-14,16,22H,3-5,8-9H2,1-2H3;4-5,8-13,15,20H,1-3,6-7H2;4-7,10-14,20,23H,1-3,8-9H2;8-9,12-15,19H,3-7,10-11H2,1-2H3.
What are the key properties of 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine?
4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine has a molecular weight of 2059.67 g/mol, XLogP of 29.57, 29 rotatable bonds, 8 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2,6-dimethoxyphenol;2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol;N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-pentan-3-ylimidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-2-[(4-phenylmethoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 160526580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).