5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide

C51H49BrCl2N10O3 — CID 159331500

IUPAC5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide
SMILESCCn1ccc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c1.Cn1cc(C2(NC(=O)c3cc4cc(Br)ccc4[nH]3)CC2)cn1.Cn1ccc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c1
InChIInChI=1S/C18H18ClN3O.C17H16ClN3O.C16H15BrN4O/c1-2-22-8-5-13(11-22)18(6-7-18)21-17(23)16-10-12-9-14(19)3-4-15(12)20-16;1-21-7-4-12(10-21)17(5-6-17)20-16(22)15-9-11-8-13(18)2-3-14(11)19-15;1-21-9-11(8-18-21)16(4-5-16)20-15(22)14-7-10-6-12(17)2-3-13(10)19-14/h3-5,8-11,20H,2,6-7H2,1H3,(H,21,23);2-4,7-10,19H,5-6H2,1H3,(H,20,22);2-3,6-9,19H,4-5H2,1H3,(H,20,22)
InChIKeyLFADAJXABBLVGU-UHFFFAOYSA-N
MW1000.83 g/mol
LogP10.72
Rot. Bonds10

About 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide

5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide (PubChem CID 159331500) has the molecular formula C51H49BrCl2N10O3 and a molecular weight of 1000.83 g/mol. Its IUPAC name is 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide
PubChem CID159331500
Molecular FormulaC51H49BrCl2N10O3
Molecular Weight1000.83 g/mol
Exact Mass998.25
IUPAC Name5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide
SMILESCCn1ccc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c1.Cn1cc(C2(NC(=O)c3cc4cc(Br)ccc4[nH]3)CC2)cn1.Cn1ccc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c1
InChIInChI=1S/C18H18ClN3O.C17H16ClN3O.C16H15BrN4O/c1-2-22-8-5-13(11-22)18(6-7-18)21-17(23)16-10-12-9-14(19)3-4-15(12)20-16;1-21-7-4-12(10-21)17(5-6-17)20-16(22)15-9-11-8-13(18)2-3-14(11)19-15;1-21-9-11(8-18-21)16(4-5-16)20-15(22)14-7-10-6-12(17)2-3-13(10)19-14/h3-5,8-11,20H,2,6-7H2,1H3,(H,21,23);2-4,7-10,19H,5-6H2,1H3,(H,20,22);2-3,6-9,19H,4-5H2,1H3,(H,20,22)
InChIKeyLFADAJXABBLVGU-UHFFFAOYSA-N
XLogP10.72
TPSA162.35 Ų
H-Bond Donors6
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms67
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001000.83
LogP ≤ 510.72
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 107

Analyze 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-[2-[[4-[1-[(5-chloro-1H-indole-2-carbonyl)amino]cyclopropyl]pyrazol-1-yl]methyl]-1-methylcyclopropyl]-1H-indole-2-carboxamide
CID 123702610
1-[3-[4-[1-[(5-chloro-1H-indole-2-carbonyl)amino]cyclopropyl]pyrazol-1-yl]phenyl]-5-cyano-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]indole-2-carboxamide
CID 137379672
5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;ethane;5-methyl-N-(1-methylcyclopropyl)-1H-indole-2-carboxamide
CID 144935683
5-chloro-N-[1-[1-(4-fluorophenyl)pyrazol-4-yl]-2-methylcyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[2-methyl-1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide
CID 145277120
acetylene;bis(5-bromo-1H-indole-2-carboxamide);1-methyl-4-[(1S,2R)-2-methylcyclopropyl]pyrazole;1-methyl-4-[(1R,2S)-2-methylcyclopropyl]pyrazole
CID 145277127
bis(5-chloro-1H-indole-2-carboxamide);1-methyl-4-[(1S,2R)-2-methylcyclopropyl]pyrazole;1-methyl-4-[(1R,2S)-2-methylcyclopropyl]pyrazole
CID 145277134
bis(5-chloro-N-[(1S,2S)-2-methyl-1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide);5-chloro-N-[(1R,2R)-2-methyl-1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide
CID 157189622
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
5-bromo-N-[1-(1-methylpyrazol-4-yl)ethyl]-1H-indole-2-carboxamide;5-bromo-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-bromo-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrazol-4-yl)cyclohexyl]-1H-indole-2-carboxamide;5-chloro-N-[(1R)-1-phenylethyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 157394513
5-bromo-7-fluoro-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(3-ethyl-1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-4-fluoro-N-[(1S,2S)-2-methyl-1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methyl-3-propan-2-ylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;4-fluoro-5-methyl-N-[(1R,2R)-2-methyl-1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide
CID 157719782
5-bromo-N-[2-methyl-1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[2-methyl-1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-cyano-N-[2-methyl-1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide
CID 157890761
1-(5-bromo-1H-indol-2-yl)-2-[(1R,2R)-2-methyl-1-(1-methylpyrazol-4-yl)cyclopropyl]ethanone;1-(5-bromo-1H-indol-2-yl)-2-[(1S,2S)-2-methyl-1-(1-methylpyrazol-4-yl)cyclopropyl]ethanone
CID 158403901

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide?
The IUPAC name of 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide (CID 159331500) is 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide.
What is the SMILES notation for 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide?
The canonical SMILES for 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide is CCn1ccc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c1.Cn1cc(C2(NC(=O)c3cc4cc(Br)ccc4[nH]3)CC2)cn1.Cn1ccc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c1.
What is the InChIKey of 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide?
The InChIKey is LFADAJXABBLVGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O.C17H16ClN3O.C16H15BrN4O/c1-2-22-8-5-13(11-22)18(6-7-18)21-17(23)16-10-12-9-14(19)3-4-15(12)20-16;1-21-7-4-12(10-21)17(5-6-17)20-16(22)15-9-11-8-13(18)2-3-14(11)19-15;1-21-9-11(8-18-21)16(4-5-16)20-15(22)14-7-10-6-12(17)2-3-13(10)19-14/h3-5,8-11,20H,2,6-7H2,1H3,(H,21,23);2-4,7-10,19H,5-6H2,1H3,(H,20,22);2-3,6-9,19H,4-5H2,1H3,(H,20,22).
What are the key properties of 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide?
5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide has a molecular weight of 1000.83 g/mol, XLogP of 10.72, 10 rotatable bonds, 6 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 159331500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).