N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide

C100H122N20O6S3 — CID 159461951

About N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide

N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide (PubChem CID 159461951) has the molecular formula C100H122N20O6S3 and a molecular weight of 1796.41 g/mol. Its IUPAC name is N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide.

Molecular Properties

• Compound Name: N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide
• PubChem CID: 159461951
• Molecular Formula: C100H122N20O6S3
• Molecular Weight: 1796.41 g/mol
• Exact Mass: 1794.90
• IUPAC Name: N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide
• SMILES: CCN(CC)CCCn1ccc2ccc(/N=C(\N)c3cccs3)cc21.N/C(=N\c1ccc2ccn(CCCN3CCOCC3)c2c1)c1ccco1.N/C(=N\c1ccc2ccn(CCCN3CCOCC3)c2c1)c1cccs1.N/C(=N\c1ccc2ccn(CCCN3CCOCC3)c2c1)c1ccoc1.N/C(=N\c1ccc2ccn(CCCN3CCOCC3)c2c1)c1ccsc1
• InChI: InChI=1S/2C20H24N4O2.2C20H24N4OS.C20H26N4S/c21-20(17-5-11-26-15-17)22-18-3-2-16-4-8-24(19(16)14-18)7-1-6-23-9-12-25-13-10-23;21-20(19-3-1-12-26-19)22-17-5-4-16-6-9-24(18(16)15-17)8-2-7-23-10-13-25-14-11-23;21-20(17-5-13-26-15-17)22-18-3-2-16-4-8-24(19(16)14-18)7-1-6-23-9-11-25-12-10-23;21-20(19-3-1-14-26-19)22-17-5-4-16-6-9-24(18(16)15-17)8-2-7-23-10-12-25-13-11-23;1-3-23(4-2)11-6-12-24-13-10-16-8-9-17(15-18(16)24)22-20(21)19-7-5-14-25-19/h2-5,8,11,14-15H,1,6-7,9-10,12-13H2,(H2,21,22);1,3-6,9,12,15H,2,7-8,10-11,13-14H2,(H2,21,22);2-5,8,13-15H,1,6-7,9-12H2,(H2,21,22);1,3-6,9,14-15H,2,7-8,10-13H2,(H2,21,22);5,7-10,13-15H,3-4,6,11-12H2,1-2H3,(H2,21,22)
• InChIKey: LURVEDOTPFCNCG-UHFFFAOYSA-N
• XLogP: 17.38
• TPSA: 295.95 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 24
• Rotatable Bonds: 32
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1796.41
LogP ≤ 5	17.38
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide?

The IUPAC name of N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide (CID 159461951) is N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide.

What is the SMILES notation for N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide?

The canonical SMILES for N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide is CCN(CC)CCCn1ccc2ccc(/N=C(\N)c3cccs3)cc21.N/C(=N\c1ccc2ccn(CCCN3CCOCC3)c2c1)c1ccco1.N/C(=N\c1ccc2ccn(CCCN3CCOCC3)c2c1)c1cccs1.N/C(=N\c1ccc2ccn(CCCN3CCOCC3)c2c1)c1ccoc1.N/C(=N\c1ccc2ccn(CCCN3CCOCC3)c2c1)c1ccsc1.

What is the InChIKey of N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide?

The InChIKey is LURVEDOTPFCNCG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H24N4O2.2C20H24N4OS.C20H26N4S/c21-20(17-5-11-26-15-17)22-18-3-2-16-4-8-24(19(16)14-18)7-1-6-23-9-12-25-13-10-23;21-20(19-3-1-12-26-19)22-17-5-4-16-6-9-24(18(16)15-17)8-2-7-23-10-13-25-14-11-23;21-20(17-5-13-26-15-17)22-18-3-2-16-4-8-24(19(16)14-18)7-1-6-23-9-11-25-12-10-23;21-20(19-3-1-14-26-19)22-17-5-4-16-6-9-24(18(16)15-17)8-2-7-23-10-12-25-13-11-23;1-3-23(4-2)11-6-12-24-13-10-16-8-9-17(15-18(16)24)22-20(21)19-7-5-14-25-19/h2-5,8,11,14-15H,1,6-7,9-10,12-13H2,(H2,21,22);1,3-6,9,12,15H,2,7-8,10-11,13-14H2,(H2,21,22);2-5,8,13-15H,1,6-7,9-12H2,(H2,21,22);1,3-6,9,14-15H,2,7-8,10-13H2,(H2,21,22);5,7-10,13-15H,3-4,6,11-12H2,1-2H3,(H2,21,22).

What are the key properties of N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide?

N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide has a molecular weight of 1796.41 g/mol, XLogP of 17.38, 32 rotatable bonds, 5 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for N'-[1-[3-(diethylamino)propyl]indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]furan-3-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-2-carboximidamide;N'-[1-(3-morpholin-4-ylpropyl)indol-6-yl]thiophene-3-carboximidamide is sourced from PubChem (CID 159461951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).