5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one

C63H73Cl4N13O3 — CID 158319476

IUPAC5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one
SMILESCC(=O)CCC1CCN(c2cc(Cl)cc3[nH]ccc23)CC1.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ccc23)C1.Cc1nc2c(n1C)CCN(c1cc(Cl)cc3[nH]ccc13)C2.O=C1NCC2(CCN(c3cc(Cl)cc4[nH]ccc34)CC2)N1
InChIInChI=1S/C17H21ClN2O.C16H17ClN4.C15H17ClN4O.C15H18ClN3O/c1-12(21)2-3-13-5-8-20(9-6-13)17-11-14(18)10-16-15(17)4-7-19-16;1-10-19-14-9-21(6-4-15(14)20(10)2)16-8-11(17)7-13-12(16)3-5-18-13;16-10-7-12-11(1-4-17-12)13(8-10)20-5-2-15(3-6-20)9-18-14(21)19-15;1-18(2)15(20)10-4-6-19(9-10)14-8-11(16)7-13-12(14)3-5-17-13/h4,7,10-11,13,19H,2-3,5-6,8-9H2,1H3;3,5,7-8,18H,4,6,9H2,1-2H3;1,4,7-8,17H,2-3,5-6,9H2,(H2,18,19,21);3,5,7-8,10,17H,4,6,9H2,1-2H3
InChIKeyGOQYHKFANSYOCP-UHFFFAOYSA-N
MW1202.18 g/mol
LogP13.04
Rot. Bonds8

About 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one

5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one (PubChem CID 158319476) has the molecular formula C63H73Cl4N13O3 and a molecular weight of 1202.18 g/mol. Its IUPAC name is 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one
PubChem CID158319476
Molecular FormulaC63H73Cl4N13O3
Molecular Weight1202.18 g/mol
Exact Mass1199.47
IUPAC Name5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one
SMILESCC(=O)CCC1CCN(c2cc(Cl)cc3[nH]ccc23)CC1.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ccc23)C1.Cc1nc2c(n1C)CCN(c1cc(Cl)cc3[nH]ccc13)C2.O=C1NCC2(CCN(c3cc(Cl)cc4[nH]ccc34)CC2)N1
InChIInChI=1S/C17H21ClN2O.C16H17ClN4.C15H17ClN4O.C15H18ClN3O/c1-12(21)2-3-13-5-8-20(9-6-13)17-11-14(18)10-16-15(17)4-7-19-16;1-10-19-14-9-21(6-4-15(14)20(10)2)16-8-11(17)7-13-12(16)3-5-18-13;16-10-7-12-11(1-4-17-12)13(8-10)20-5-2-15(3-6-20)9-18-14(21)19-15;1-18(2)15(20)10-4-6-19(9-10)14-8-11(16)7-13-12(14)3-5-17-13/h4,7,10-11,13,19H,2-3,5-6,8-9H2,1H3;3,5,7-8,18H,4,6,9H2,1-2H3;1,4,7-8,17H,2-3,5-6,9H2,(H2,18,19,21);3,5,7-8,10,17H,4,6,9H2,1-2H3
InChIKeyGOQYHKFANSYOCP-UHFFFAOYSA-N
XLogP13.04
TPSA172.45 Ų
H-Bond Donors6
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms83
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001202.18
LogP ≤ 513.04
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 109

Analyze 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one 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

Indolicidin & Pyrimethamine
CID 16130479
5-(4-chloro-3-fluorophenyl)-4-[2-[1-[3-[2-[[5-(2-chlorophenyl)-1-(3-imidazol-1-ylpropyl)-2-oxoimidazolidin-4-ylidene]amino]ethyl]-1H-indol-6-yl]indol-3-yl]ethylimino]-1-(3-imidazol-1-ylpropyl)imidazolidin-2-one
CID 143667519
8-(6-chloro-1H-indol-4-yl)-1,8-diazaspiro[4.5]decan-2-one;N-methyl-N-[4-(4-methylsulfonylpiperazin-1-yl)-1H-indol-6-yl]acetamide;4-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]-6-(trifluoromethyl)-1H-indole;2-methyl-5-[6-(trifluoromethyl)-1H-indol-4-yl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 157942579
(2R)-2-[[2-(5-chloro-1H-indol-3-yl)-5-fluoropyrimidin-4-yl]amino]-3-methyl-N-(2,2,2-trifluoroethyl)butanamide;(2R)-1-[2-(5-chloro-1H-indol-3-yl)-5-fluoropyrimidin-4-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide;2-[[2-(5-chloro-1H-indol-3-yl)pyrimidin-4-yl]amino]-2-methyl-N-(2,2,2-trifluoroethyl)propanamide;(1S)-2-[2-(5-chloro-1H-indol-3-yl)pyrimidin-4-yl]-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide;molecular hydrogen
CID 161940109
6-chloro-3-[3-[1-(4-chlorophenyl)ethyl]-5-phenylimidazol-4-yl]-N-[2-[4-(pyrrolidine-1-carbonylamino)piperidin-1-yl]-3-pyridinyl]-1H-indole-2-carboxamide
CID 71155232
6-chloro-3-[3-[1-(4-chlorophenyl)ethyl]-5-phenylimidazol-4-yl]-N-[2-[4-[[(2S)-pyrrolidine-2-carbonyl]amino]piperidin-1-yl]-3-pyridinyl]-1H-indole-2-carboxamide
CID 71155240
N-[2-[4-[[(2S)-1-acetylpyrrolidine-2-carbonyl]amino]piperidin-1-yl]-3-pyridinyl]-6-chloro-3-[3-[1-(4-chlorophenyl)ethyl]-5-phenylimidazol-4-yl]-1H-indole-2-carboxamide
CID 71155426
6-chloro-3-[3-[(1S)-1-(4-chlorophenyl)ethyl]-5-phenylimidazol-4-yl]-N-[2-[4-[[(2S)-1-methylpyrrolidine-2-carbonyl]amino]piperidin-1-yl]-3-pyridinyl]-1H-indole-2-carboxamide
CID 71155729
6-chloro-3-[3-[(1S)-1-(4-chlorophenyl)ethyl]-5-phenylimidazol-4-yl]-N-[2-[4-[[(2R)-pyrrolidine-2-carbonyl]amino]piperidin-1-yl]-3-pyridinyl]-1H-indole-2-carboxamide
CID 71155742
6-chloro-3-[3-[(1S)-1-(4-chlorophenyl)ethyl]-5-phenylimidazol-4-yl]-N-[2-[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]-3-pyridinyl]-1H-indole-2-carboxamide
CID 71155749
6-chloro-3-[3-[1-(4-chlorophenyl)ethyl]-5-phenylimidazol-4-yl]-N-[2-[4-(2-oxo-1,3-diazinan-1-yl)piperidin-1-yl]-3-pyridinyl]-1H-indole-2-carboxamide
CID 71155753
6-chloro-3-[3-[(1S)-1-(4-chlorophenyl)ethyl]-5-phenylimidazol-4-yl]-N-[5-methyl-2-[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]-3-pyridinyl]-1H-indole-2-carboxamide
CID 71155758

Frequently Asked Questions

What is the IUPAC name of 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one?
The IUPAC name of 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one (CID 158319476) is 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one.
What is the SMILES notation for 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one?
The canonical SMILES for 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one is CC(=O)CCC1CCN(c2cc(Cl)cc3[nH]ccc23)CC1.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ccc23)C1.Cc1nc2c(n1C)CCN(c1cc(Cl)cc3[nH]ccc13)C2.O=C1NCC2(CCN(c3cc(Cl)cc4[nH]ccc34)CC2)N1.
What is the InChIKey of 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one?
The InChIKey is GOQYHKFANSYOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21ClN2O.C16H17ClN4.C15H17ClN4O.C15H18ClN3O/c1-12(21)2-3-13-5-8-20(9-6-13)17-11-14(18)10-16-15(17)4-7-19-16;1-10-19-14-9-21(6-4-15(14)20(10)2)16-8-11(17)7-13-12(16)3-5-18-13;16-10-7-12-11(1-4-17-12)13(8-10)20-5-2-15(3-6-20)9-18-14(21)19-15;1-18(2)15(20)10-4-6-19(9-10)14-8-11(16)7-13-12(14)3-5-17-13/h4,7,10-11,13,19H,2-3,5-6,8-9H2,1H3;3,5,7-8,18H,4,6,9H2,1-2H3;1,4,7-8,17H,2-3,5-6,9H2,(H2,18,19,21);3,5,7-8,10,17H,4,6,9H2,1-2H3.
What are the key properties of 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one?
5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one has a molecular weight of 1202.18 g/mol, XLogP of 13.04, 8 rotatable bonds, 6 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-chloro-1H-indol-4-yl)-1,2-dimethyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine;1-(6-chloro-1H-indol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-[1-(6-chloro-1H-indol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one is sourced from PubChem (CID 158319476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).