5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide

C107H109BrCl5N19O7 — CID 157356102

IUPAC5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide
SMILESCC(C)C(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cnn(C)c1.CC(NC(=O)c1cc2cc(Br)ccc2[nH]1)c1cnn(C)c1.CCC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cnn(C)c1.CN1CCC(C(NC(=O)c2cc3cc(Cl)ccc3[nH]2)c2ccccc2)CC1.C[C@@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1.O=C(NC1(c2ccccc2)CCOCC1)c1cc2cc(Cl)ccc2[nH]1
InChIInChI=1S/C22H24ClN3O.C20H19ClN2O2.C17H19ClN4O.C17H15ClN2O.C16H17ClN4O.C15H15BrN4O/c1-26-11-9-16(10-12-26)21(15-5-3-2-4-6-15)25-22(27)20-14-17-13-18(23)7-8-19(17)24-20;21-16-6-7-17-14(12-16)13-18(22-17)19(24)23-20(8-10-25-11-9-20)15-4-2-1-3-5-15;1-10(2)16(12-8-19-22(3)9-12)21-17(23)15-7-11-6-13(18)4-5-14(11)20-15;1-11(12-5-3-2-4-6-12)19-17(21)16-10-13-9-14(18)7-8-15(13)20-16;1-3-13(11-8-18-21(2)9-11)20-16(22)15-7-10-6-12(17)4-5-14(10)19-15;1-9(11-7-17-20(2)8-11)18-15(21)14-6-10-5-12(16)3-4-13(10)19-14/h2-8,13-14,16,21,24H,9-12H2,1H3,(H,25,27);1-7,12-13,22H,8-11H2,(H,23,24);4-10,16,20H,1-3H3,(H,21,23);2-11,20H,1H3,(H,19,21);4-9,13,19H,3H2,1-2H3,(H,20,22);3-9,19H,1-2H3,(H,18,21)/t;;;11-;;/m...1../s1
InChIKeyBICGDWPDFQFLNA-ISXKTASQSA-N
MW2030.34 g/mol
LogP23.48
Rot. Bonds21

About 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide

5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide (PubChem CID 157356102) has the molecular formula C107H109BrCl5N19O7 and a molecular weight of 2030.34 g/mol. Its IUPAC name is 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide
PubChem CID157356102
Molecular FormulaC107H109BrCl5N19O7
Molecular Weight2030.34 g/mol
Exact Mass2025.64
IUPAC Name5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide
SMILESCC(C)C(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cnn(C)c1.CC(NC(=O)c1cc2cc(Br)ccc2[nH]1)c1cnn(C)c1.CCC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cnn(C)c1.CN1CCC(C(NC(=O)c2cc3cc(Cl)ccc3[nH]2)c2ccccc2)CC1.C[C@@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1.O=C(NC1(c2ccccc2)CCOCC1)c1cc2cc(Cl)ccc2[nH]1
InChIInChI=1S/C22H24ClN3O.C20H19ClN2O2.C17H19ClN4O.C17H15ClN2O.C16H17ClN4O.C15H15BrN4O/c1-26-11-9-16(10-12-26)21(15-5-3-2-4-6-15)25-22(27)20-14-17-13-18(23)7-8-19(17)24-20;21-16-6-7-17-14(12-16)13-18(22-17)19(24)23-20(8-10-25-11-9-20)15-4-2-1-3-5-15;1-10(2)16(12-8-19-22(3)9-12)21-17(23)15-7-11-6-13(18)4-5-14(11)20-15;1-11(12-5-3-2-4-6-12)19-17(21)16-10-13-9-14(18)7-8-15(13)20-16;1-3-13(11-8-18-21(2)9-11)20-16(22)15-7-10-6-12(17)4-5-14(10)19-15;1-9(11-7-17-20(2)8-11)18-15(21)14-6-10-5-12(16)3-4-13(10)19-14/h2-8,13-14,16,21,24H,9-12H2,1H3,(H,25,27);1-7,12-13,22H,8-11H2,(H,23,24);4-10,16,20H,1-3H3,(H,21,23);2-11,20H,1H3,(H,19,21);4-9,13,19H,3H2,1-2H3,(H,20,22);3-9,19H,1-2H3,(H,18,21)/t;;;11-;;/m...1../s1
InChIKeyBICGDWPDFQFLNA-ISXKTASQSA-N
XLogP23.48
TPSA335.27 Ų
H-Bond Donors12
H-Bond Acceptors14
Rotatable Bonds21
Heavy Atoms139
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002030.34
LogP ≤ 523.48
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1014

Analyze 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide?
The IUPAC name of 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide (CID 157356102) is 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide.
What is the SMILES notation for 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide?
The canonical SMILES for 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide is CC(C)C(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cnn(C)c1.CC(NC(=O)c1cc2cc(Br)ccc2[nH]1)c1cnn(C)c1.CCC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cnn(C)c1.CN1CCC(C(NC(=O)c2cc3cc(Cl)ccc3[nH]2)c2ccccc2)CC1.C[C@@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1.O=C(NC1(c2ccccc2)CCOCC1)c1cc2cc(Cl)ccc2[nH]1.
What is the InChIKey of 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide?
The InChIKey is BICGDWPDFQFLNA-ISXKTASQSA-N. The full InChI is InChI=1S/C22H24ClN3O.C20H19ClN2O2.C17H19ClN4O.C17H15ClN2O.C16H17ClN4O.C15H15BrN4O/c1-26-11-9-16(10-12-26)21(15-5-3-2-4-6-15)25-22(27)20-14-17-13-18(23)7-8-19(17)24-20;21-16-6-7-17-14(12-16)13-18(22-17)19(24)23-20(8-10-25-11-9-20)15-4-2-1-3-5-15;1-10(2)16(12-8-19-22(3)9-12)21-17(23)15-7-11-6-13(18)4-5-14(11)20-15;1-11(12-5-3-2-4-6-12)19-17(21)16-10-13-9-14(18)7-8-15(13)20-16;1-3-13(11-8-18-21(2)9-11)20-16(22)15-7-10-6-12(17)4-5-14(10)19-15;1-9(11-7-17-20(2)8-11)18-15(21)14-6-10-5-12(16)3-4-13(10)19-14/h2-8,13-14,16,21,24H,9-12H2,1H3,(H,25,27);1-7,12-13,22H,8-11H2,(H,23,24);4-10,16,20H,1-3H3,(H,21,23);2-11,20H,1H3,(H,19,21);4-9,13,19H,3H2,1-2H3,(H,20,22);3-9,19H,1-2H3,(H,18,21)/t;;;11-;;/m...1../s1.
What are the key properties of 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide?
5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide has a molecular weight of 2030.34 g/mol, XLogP of 23.48, 21 rotatable bonds, 12 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1-methylpiperidin-4-yl)-phenylmethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)propyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-(4-phenyloxan-4-yl)-1H-indole-2-carboxamide is sourced from PubChem (CID 157356102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).