N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide

C113H126N24O2S4 — CID 159644121

About N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide

N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide (PubChem CID 159644121) has the molecular formula C113H126N24O2S4 and a molecular weight of 1980.68 g/mol. Its IUPAC name is N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide.

Molecular Properties

• Compound Name: N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide
• PubChem CID: 159644121
• Molecular Formula: C113H126N24O2S4
• Molecular Weight: 1980.68 g/mol
• Exact Mass: 1978.94
• IUPAC Name: N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide
• SMILES: CN(C)CCc1c[nH]c2ccc(/N=C(\N)c3cccs3)cc12.CN1CC=C(c2c[nH]c3ccc(/N=C(\N)c4ccco4)cc23)CC1.CN1CC=C(c2c[nH]c3ccc(/N=C(\N)c4cccs4)cc23)CC1.CN1CC=C(c2c[nH]c3ccc(C/N=C(\N)c4cccs4)cc23)CC1.CN1CCC(c2c[nH]c3ccc(/N=C(\N)c4ccco4)cc23)CC1.CN1CCC(c2c[nH]c3ccc(/N=C(\N)c4cccs4)cc23)CC1
• InChI: InChI=1S/C20H22N4S.C19H22N4O.C19H20N4O.C19H22N4S.C19H20N4S.C17H20N4S/c1-24-8-6-15(7-9-24)17-13-22-18-5-4-14(11-16(17)18)12-23-20(21)19-3-2-10-25-19;4*1-23-8-6-13(7-9-23)16-12-21-17-5-4-14(11-15(16)17)22-19(20)18-3-2-10-24-18;1-21(2)8-7-12-11-19-15-6-5-13(10-14(12)15)20-17(18)16-4-3-9-22-16/h2-6,10-11,13,22H,7-9,12H2,1H3,(H2,21,23);2-5,10-13,21H,6-9H2,1H3,(H2,20,22);2-6,10-12,21H,7-9H2,1H3,(H2,20,22);2-5,10-13,21H,6-9H2,1H3,(H2,20,22);2-6,10-12,21H,7-9H2,1H3,(H2,20,22);3-6,9-11,19H,7-8H2,1-2H3,(H2,18,20)
• InChIKey: MQSUWZXRHKEOCT-UHFFFAOYSA-N
• XLogP: 22.41
• TPSA: 370.74 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 18
• Rotatable Bonds: 21
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1980.68
LogP ≤ 5	22.41
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	18

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'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide?

The IUPAC name of N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide (CID 159644121) is N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide.

What is the SMILES notation for N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide?

The canonical SMILES for N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide is CN(C)CCc1c[nH]c2ccc(/N=C(\N)c3cccs3)cc12.CN1CC=C(c2c[nH]c3ccc(/N=C(\N)c4ccco4)cc23)CC1.CN1CC=C(c2c[nH]c3ccc(/N=C(\N)c4cccs4)cc23)CC1.CN1CC=C(c2c[nH]c3ccc(C/N=C(\N)c4cccs4)cc23)CC1.CN1CCC(c2c[nH]c3ccc(/N=C(\N)c4ccco4)cc23)CC1.CN1CCC(c2c[nH]c3ccc(/N=C(\N)c4cccs4)cc23)CC1.

What is the InChIKey of N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide?

The InChIKey is MQSUWZXRHKEOCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4S.C19H22N4O.C19H20N4O.C19H22N4S.C19H20N4S.C17H20N4S/c1-24-8-6-15(7-9-24)17-13-22-18-5-4-14(11-16(17)18)12-23-20(21)19-3-2-10-25-19;4*1-23-8-6-13(7-9-23)16-12-21-17-5-4-14(11-15(16)17)22-19(20)18-3-2-10-24-18;1-21(2)8-7-12-11-19-15-6-5-13(10-14(12)15)20-17(18)16-4-3-9-22-16/h2-6,10-11,13,22H,7-9,12H2,1H3,(H2,21,23);2-5,10-13,21H,6-9H2,1H3,(H2,20,22);2-6,10-12,21H,7-9H2,1H3,(H2,20,22);2-5,10-13,21H,6-9H2,1H3,(H2,20,22);2-6,10-12,21H,7-9H2,1H3,(H2,20,22);3-6,9-11,19H,7-8H2,1-2H3,(H2,18,20).

What are the key properties of N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide?

N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide has a molecular weight of 1980.68 g/mol, XLogP of 22.41, 21 rotatable bonds, 12 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N'-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]methyl]thiophene-2-carboximidamide;N'-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]furan-2-carboximidamide;N'-[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl]thiophene-2-carboximidamide is sourced from PubChem (CID 159644121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).