2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine

C84H96N24O4 — CID 157253284

About 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine

2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine (PubChem CID 157253284) has the molecular formula C84H96N24O4 and a molecular weight of 1505.86 g/mol. Its IUPAC name is 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine.

Molecular Properties

• Compound Name: 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine
• PubChem CID: 157253284
• Molecular Formula: C84H96N24O4
• Molecular Weight: 1505.86 g/mol
• Exact Mass: 1504.80
• IUPAC Name: 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine
• SMILES: [H]/N=C1C(=N/c2c(OCCCN(C)C)nn3ccccc23)/C=C(C)c2[nH]ccc2/1.[H]/N=C1C(=N/c2c(OCCN(C)C)nn3ccccc23)/C=C(C)c2[nH]ccc2/1.[H]/N=C1C(=N/c2c(OCCN(C)C)nn3ccccc23)/C=C(CC)c2[nH]ccc2/1.[H]/N=C1C(=N\c2c(OCCN(C)C)nn3ccccc23)\C=C(C)c2[nH]c(C)c(C)c2\1
• InChI: InChI=1S/C22H26N6O.2C21H24N6O.C20H22N6O/c1-13-12-16(19(23)18-14(2)15(3)24-20(13)18)25-21-17-8-6-7-9-28(17)26-22(21)29-11-10-27(4)5;1-14-13-16(18(22)15-8-9-23-19(14)15)24-20-17-7-4-5-11-27(17)25-21(20)28-12-6-10-26(2)3;1-4-14-13-16(18(22)15-8-9-23-19(14)15)24-20-17-7-5-6-10-27(17)25-21(20)28-12-11-26(2)3;1-13-12-15(17(21)14-7-8-22-18(13)14)23-19-16-6-4-5-9-26(16)24-20(19)27-11-10-25(2)3/h6-9,12,23-24H,10-11H2,1-5H3;4-5,7-9,11,13,22-23H,6,10,12H2,1-3H3;5-10,13,22-23H,4,11-12H2,1-3H3;4-9,12,21-22H,10-11H2,1-3H3/b23-19+,25-16+;2*22-18+,24-16+;21-17+,23-15+
• InChIKey: AWOVPOQHRWJPET-KSVMBZATSA-N
• XLogP: 14.04
• TPSA: 327.08 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 24
• Rotatable Bonds: 22
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1505.86
LogP ≤ 5	14.04
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'quinone_D(2)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine?

The IUPAC name of 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine (CID 157253284) is 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine.

What is the SMILES notation for 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine?

The canonical SMILES for 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine is [H]/N=C1C(=N/c2c(OCCCN(C)C)nn3ccccc23)/C=C(C)c2[nH]ccc2/1.[H]/N=C1C(=N/c2c(OCCN(C)C)nn3ccccc23)/C=C(C)c2[nH]ccc2/1.[H]/N=C1C(=N/c2c(OCCN(C)C)nn3ccccc23)/C=C(CC)c2[nH]ccc2/1.[H]/N=C1C(=N\c2c(OCCN(C)C)nn3ccccc23)\C=C(C)c2[nH]c(C)c(C)c2\1.

What is the InChIKey of 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine?

The InChIKey is AWOVPOQHRWJPET-KSVMBZATSA-N. The full InChI is InChI=1S/C22H26N6O.2C21H24N6O.C20H22N6O/c1-13-12-16(19(23)18-14(2)15(3)24-20(13)18)25-21-17-8-6-7-9-28(17)26-22(21)29-11-10-27(4)5;1-14-13-16(18(22)15-8-9-23-19(14)15)24-20-17-7-4-5-11-27(17)25-21(20)28-12-6-10-26(2)3;1-4-14-13-16(18(22)15-8-9-23-19(14)15)24-20-17-7-5-6-10-27(17)25-21(20)28-12-11-26(2)3;1-13-12-15(17(21)14-7-8-22-18(13)14)23-19-16-6-4-5-9-26(16)24-20(19)27-11-10-25(2)3/h6-9,12,23-24H,10-11H2,1-5H3;4-5,7-9,11,13,22-23H,6,10,12H2,1-3H3;5-10,13,22-23H,4,11-12H2,1-3H3;4-9,12,21-22H,10-11H2,1-3H3/b23-19+,25-16+;2*22-18+,24-16+;21-17+,23-15+.

What are the key properties of 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine?

2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine has a molecular weight of 1505.86 g/mol, XLogP of 14.04, 22 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[(7-ethyl-4-imino-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;2-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine;3-[3-[(4-imino-7-methyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylpropan-1-amine;2-[3-[(4-imino-2,3,7-trimethyl-1H-indol-5-ylidene)amino]pyrazolo[1,5-a]pyridin-2-yl]oxy-N,N-dimethylethanamine is sourced from PubChem (CID 157253284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).