N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole

C61H70Cl4N20O2 — CID 158080033

IUPACN-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole
SMILESCC(=O)NCCN1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.CNC(=O)NC1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.Clc1cc(N2CCN(c3cccnc3)CC2)c2cn[nH]c2c1.Clc1cc(N2CCN(c3ccncc3)CC2)c2cn[nH]c2c1
InChIInChI=1S/2C16H16ClN5.C15H20ClN5O.C14H18ClN5O/c17-12-9-15-14(11-19-20-15)16(10-12)22-7-5-21(6-8-22)13-1-3-18-4-2-13;17-12-8-15-14(11-19-20-15)16(9-12)22-6-4-21(5-7-22)13-2-1-3-18-10-13;1-11(22)17-2-3-20-4-6-21(7-5-20)15-9-12(16)8-14-13(15)10-18-19-14;1-16-14(21)18-10-2-4-20(5-3-10)13-7-9(15)6-12-11(13)8-17-19-12/h1-4,9-11H,5-8H2,(H,19,20);1-3,8-11H,4-7H2,(H,19,20);8-10H,2-7H2,1H3,(H,17,22)(H,18,19);6-8,10H,2-5H2,1H3,(H,17,19)(H2,16,18,21)
InChIKeyFMVNCYJHJTXWOS-UHFFFAOYSA-N
MW1257.18 g/mol
LogP9.46
Rot. Bonds10

About N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole

N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole (PubChem CID 158080033) has the molecular formula C61H70Cl4N20O2 and a molecular weight of 1257.18 g/mol. Its IUPAC name is N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole.

Molecular Properties

Compound NameN-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole
PubChem CID158080033
Molecular FormulaC61H70Cl4N20O2
Molecular Weight1257.18 g/mol
Exact Mass1254.47
IUPAC NameN-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole
SMILESCC(=O)NCCN1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.CNC(=O)NC1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.Clc1cc(N2CCN(c3cccnc3)CC2)c2cn[nH]c2c1.Clc1cc(N2CCN(c3ccncc3)CC2)c2cn[nH]c2c1
InChIInChI=1S/2C16H16ClN5.C15H20ClN5O.C14H18ClN5O/c17-12-9-15-14(11-19-20-15)16(10-12)22-7-5-21(6-8-22)13-1-3-18-4-2-13;17-12-8-15-14(11-19-20-15)16(9-12)22-6-4-21(5-7-22)13-2-1-3-18-10-13;1-11(22)17-2-3-20-4-6-21(7-5-20)15-9-12(16)8-14-13(15)10-18-19-14;1-16-14(21)18-10-2-4-20(5-3-10)13-7-9(15)6-12-11(13)8-17-19-12/h1-4,9-11H,5-8H2,(H,19,20);1-3,8-11H,4-7H2,(H,19,20);8-10H,2-7H2,1H3,(H,17,22)(H,18,19);6-8,10H,2-5H2,1H3,(H,17,19)(H2,16,18,21)
InChIKeyFMVNCYJHJTXWOS-UHFFFAOYSA-N
XLogP9.46
TPSA233.41 Ų
H-Bond Donors7
H-Bond Acceptors15
Rotatable Bonds10
Heavy Atoms87
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001257.18
LogP ≤ 59.46
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1015

Analyze N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole with MolForge

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Related Compounds

6-chloro-4-(3-ethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpiperazine-1-carboxamide;4-(6-chloro-1H-indazol-4-yl)-N-methylpiperazine-1-carboxamide;4-(6-chloro-1H-indazol-4-yl)piperazine-1-sulfonamide;1-[2,2-dimethyl-4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperazin-1-yl]ethanone
CID 160070402
6-chloro-3-[2-[1-[2-(6-chloro-2H-indazol-3-yl)ethyl]-4,4-bis(1H-indol-4-yl)piperazin-4-ium-2-yl]ethyl]-2H-indazole
CID 53661899
N-[5-[3-[4-[3-[5-[5-(ethylaminomethyl)-3-pyridinyl]-3-(4-piperidin-1-yl-1H-indol-2-yl)-2H-pyrazolo[3,4-c]pyridin-7-yl]piperidin-1-yl]-1H-indol-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]-2-methylpropanamide
CID 145254829
8-(6-chloro-1H-indazol-4-yl)-3-(cyclohexylmethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-[2-(dimethylamino)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;(1R,5S)-3-(6-chloro-1H-indol-4-yl)-3,6-diazabicyclo[3.2.2]nonan-7-one;3-(6-chloro-1H-indol-4-yl)-3,10-diazaspiro[5.6]dodecan-9-one
CID 157162653
6-chloro-4-(3-ethyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;4-(6-chloro-1H-indol-4-yl)-N,N-dimethylpiperazine-1-carboxamide;4-(6-chloro-1H-indol-4-yl)-N-methylpiperazine-1-carboxamide;4-(6-chloro-1H-indol-4-yl)piperazine-1-sulfonamide
CID 157299475
6-chloro-4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1-methylindazole;4-(6-chloro-1H-indazol-4-yl)piperazine-1-carboxamide;[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-cyclopropylmethanone;1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-methylpropan-1-one;1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]propan-1-one
CID 157541172
2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-N,N-dimethylacetamide;6-chloro-4-[4-(2-methoxyethylsulfonyl)piperazin-1-yl]-1H-indole;6-chloro-3-methyl-4-(4-methylsulfonylpiperazin-1-yl)-1H-indole;6-chloro-4-(4-propylsulfonylpiperazin-1-yl)-1H-indole
CID 157677228
N-(3-chlorophenyl)-3-(2-fluoro-3-pyridinyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-(6-fluoro-3-pyridinyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide;N-(3-chlorophenyl)-3-pyridin-3-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
CID 157683772
1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrrolidin-2-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)pyrazol-1-yl]ethyl]methanesulfonamide;1'-(6-chloro-1H-indazol-4-yl)spiro[1H-indole-3,4'-piperidine]-2-one;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole
CID 157748492
3-amino-1-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;1-(4-chlorophenyl)-3-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]pyrrolo[2,3-c]pyridine;1-(4-chlorophenyl)-3-[1-(1H-pyrazol-5-ylmethyl)piperidin-4-yl]pyrrolo[2,3-c]pyridine;2-[4-[1-(4-chlorophenyl)pyrrolo[2,3-c]pyridin-3-yl]piperidin-1-yl]ethanol;hydrochloride
CID 157772852
4-(6-chloro-1H-indazol-4-yl)piperazine-1-carboxamide;[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-cyclopropylmethanone;1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-methylpropan-1-one;1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]propan-1-one
CID 157792385
N-[[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methyl]acetamide;N-[[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methyl]methanesulfonamide;N-[[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methyl]-N-methylacetamide;N-[[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]methyl]-N-methylacetamide;N-[[1-(6-chloro-1H-indazol-4-yl)piperidin-3-yl]methyl]-N-methylmethanesulfonamide
CID 157831103

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole?
The IUPAC name of N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole (CID 158080033) is N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole.
What is the SMILES notation for N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole?
The canonical SMILES for N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole is CC(=O)NCCN1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.CNC(=O)NC1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.Clc1cc(N2CCN(c3cccnc3)CC2)c2cn[nH]c2c1.Clc1cc(N2CCN(c3ccncc3)CC2)c2cn[nH]c2c1.
What is the InChIKey of N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole?
The InChIKey is FMVNCYJHJTXWOS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H16ClN5.C15H20ClN5O.C14H18ClN5O/c17-12-9-15-14(11-19-20-15)16(10-12)22-7-5-21(6-8-22)13-1-3-18-4-2-13;17-12-8-15-14(11-19-20-15)16(9-12)22-6-4-21(5-7-22)13-2-1-3-18-10-13;1-11(22)17-2-3-20-4-6-21(7-5-20)15-9-12(16)8-14-13(15)10-18-19-14;1-16-14(21)18-10-2-4-20(5-3-10)13-7-9(15)6-12-11(13)8-17-19-12/h1-4,9-11H,5-8H2,(H,19,20);1-3,8-11H,4-7H2,(H,19,20);8-10H,2-7H2,1H3,(H,17,22)(H,18,19);6-8,10H,2-5H2,1H3,(H,17,19)(H2,16,18,21).
What are the key properties of N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole?
N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole has a molecular weight of 1257.18 g/mol, XLogP of 9.46, 10 rotatable bonds, 7 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-3-methylurea;6-chloro-4-(4-pyridin-3-ylpiperazin-1-yl)-1H-indazole;6-chloro-4-(4-pyridin-4-ylpiperazin-1-yl)-1H-indazole is sourced from PubChem (CID 158080033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).