N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine

C42H63Cl2FN8O6S2Si2 — CID 162171268

IUPACN-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(NS(=O)(=O)C2CCN(c3ccc(Cl)cn3)CC2)nc1.CC(C)(C)[Si](C)(C)Oc1ccc(NS(=O)(=O)C2CCNCC2)nc1.Fc1ccc(Cl)cn1
InChIInChI=1S/C21H31ClN4O3SSi.C16H29N3O3SSi.C5H3ClFN/c1-21(2,3)31(4,5)29-17-7-8-19(23-15-17)25-30(27,28)18-10-12-26(13-11-18)20-9-6-16(22)14-24-20;1-16(2,3)24(4,5)22-13-6-7-15(18-12-13)19-23(20,21)14-8-10-17-11-9-14;6-4-1-2-5(7)8-3-4/h6-9,14-15,18H,10-13H2,1-5H3,(H,23,25);6-7,12,14,17H,8-11H2,1-5H3,(H,18,19);1-3H
InChIKeyZNVAEQHHNOHZSK-UHFFFAOYSA-N
MW986.23 g/mol
LogP9.76
Rot. Bonds11

About N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine

N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine (PubChem CID 162171268) has the molecular formula C42H63Cl2FN8O6S2Si2 and a molecular weight of 986.23 g/mol. Its IUPAC name is N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine.

Molecular Properties

Compound NameN-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine
PubChem CID162171268
Molecular FormulaC42H63Cl2FN8O6S2Si2
Molecular Weight986.23 g/mol
Exact Mass984.32
IUPAC NameN-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(NS(=O)(=O)C2CCN(c3ccc(Cl)cn3)CC2)nc1.CC(C)(C)[Si](C)(C)Oc1ccc(NS(=O)(=O)C2CCNCC2)nc1.Fc1ccc(Cl)cn1
InChIInChI=1S/C21H31ClN4O3SSi.C16H29N3O3SSi.C5H3ClFN/c1-21(2,3)31(4,5)29-17-7-8-19(23-15-17)25-30(27,28)18-10-12-26(13-11-18)20-9-6-16(22)14-24-20;1-16(2,3)24(4,5)22-13-6-7-15(18-12-13)19-23(20,21)14-8-10-17-11-9-14;6-4-1-2-5(7)8-3-4/h6-9,14-15,18H,10-13H2,1-5H3,(H,23,25);6-7,12,14,17H,8-11H2,1-5H3,(H,18,19);1-3H
InChIKeyZNVAEQHHNOHZSK-UHFFFAOYSA-N
XLogP9.76
TPSA177.63 Ų
H-Bond Donors3
H-Bond Acceptors12
Rotatable Bonds11
Heavy Atoms63
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500986.23
LogP ≤ 59.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine with MolForge

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Launch Full Analysis

Related Compounds

N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(4-chlorophenyl)piperidine-4-sulfonamide
CID 155632621
N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-4-(5-chloro-2-pyridinyl)piperazine-1-sulfonamide
CID 155632646
N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-4-(5-fluoro-2-pyridinyl)-1,4-diazepane-1-carboxamide;1-(5-chloro-2-pyridinyl)-1,4-diazepane;(4-fluorophenyl) N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]carbamate
CID 158854384
N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-2-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]acetamide;2-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]-N-(5-hydroxy-2-pyridinyl)acetamide;oxolane;hydrochloride
CID 161372436
N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-4-(4-chlorophenyl)piperidine-1-carboxamide;4-(4-chlorophenyl)piperidine;(4-fluorophenyl) N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]carbamate
CID 159741683
N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-4-(4-fluorophenyl)piperazine-1-carboxamide
CID 155632677
[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl] 4-[5-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxylate
CID 150291106
piperidin-4-yl N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-N-(4-chlorophenyl)carbamate
CID 175066216
5-chloro-2-(4-methoxypiperidin-1-yl)pyridine
CID 66233187
N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-4-[(4-fluorophenyl)methyl]piperazine-1-carboxamide
CID 151857612
[4-(5-chloro-2-pyridinyl)piperazin-1-yl]-[(2S,4S)-2-methylpiperidin-4-yl]methanone
CID 120634302
1-(5-chloro-2-pyridinyl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide
CID 39394641

Frequently Asked Questions

What is the IUPAC name of N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine?
The IUPAC name of N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine (CID 162171268) is N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine.
What is the SMILES notation for N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine?
The canonical SMILES for N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine is CC(C)(C)[Si](C)(C)Oc1ccc(NS(=O)(=O)C2CCN(c3ccc(Cl)cn3)CC2)nc1.CC(C)(C)[Si](C)(C)Oc1ccc(NS(=O)(=O)C2CCNCC2)nc1.Fc1ccc(Cl)cn1.
What is the InChIKey of N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine?
The InChIKey is ZNVAEQHHNOHZSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31ClN4O3SSi.C16H29N3O3SSi.C5H3ClFN/c1-21(2,3)31(4,5)29-17-7-8-19(23-15-17)25-30(27,28)18-10-12-26(13-11-18)20-9-6-16(22)14-24-20;1-16(2,3)24(4,5)22-13-6-7-15(18-12-13)19-23(20,21)14-8-10-17-11-9-14;6-4-1-2-5(7)8-3-4/h6-9,14-15,18H,10-13H2,1-5H3,(H,23,25);6-7,12,14,17H,8-11H2,1-5H3,(H,18,19);1-3H.
What are the key properties of N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine?
N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine has a molecular weight of 986.23 g/mol, XLogP of 9.76, 11 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]-1-(5-chloro-2-pyridinyl)piperidine-4-sulfonamide;N-[5-[tert-butyl(dimethyl)silyl]oxy-2-pyridinyl]piperidine-4-sulfonamide;5-chloro-2-fluoropyridine is sourced from PubChem (CID 162171268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).