diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide

C64H74I8N8O11V2- — CID 160574245

IUPACdiiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide
SMILESI[I-]I.I[V](I)I.I[V]I.NOC1CCCCO1.O=C(NCC1CCN(c2ccc(C(=O)NOC3CCCCO3)cn2)CC1)OCC1c2ccccc2-c2ccccc21.O=C(NCC1CCN(c2ccc(C(=O)O)cn2)CC1)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C32H36N4O5.C27H27N3O4.C5H11NO2.I3.5HI.2V/c37-31(35-41-30-11-5-6-18-39-30)23-12-13-29(33-20-23)36-16-14-22(15-17-36)19-34-32(38)40-21-28-26-9-3-1-7-24(26)25-8-2-4-10-27(25)28;31-26(32)19-9-10-25(28-16-19)30-13-11-18(12-14-30)15-29-27(33)34-17-24-22-7-3-1-5-20(22)21-6-2-4-8-23(21)24;6-8-5-3-1-2-4-7-5;1-3-2;;;;;;;/h1-4,7-10,12-13,20,22,28,30H,5-6,11,14-19,21H2,(H,34,38)(H,35,37);1-10,16,18,24H,11-15,17H2,(H,29,33)(H,31,32);5H,1-4,6H2;;5*1H;;/q;;;-1;;;;;;+2;+3/p-5
InChIKeySYWWYWSUAQOGGO-UHFFFAOYSA-I
MW2248.46 g/mol
LogP13.16
Rot. Bonds15

About diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide

diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide (PubChem CID 160574245) has the molecular formula C64H74I8N8O11V2- and a molecular weight of 2248.46 g/mol. Its IUPAC name is diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide.

Molecular Properties

Compound Namediiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide
PubChem CID160574245
Molecular FormulaC64H74I8N8O11V2-
Molecular Weight2248.46 g/mol
Exact Mass2247.67
IUPAC Namediiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide
SMILESI[I-]I.I[V](I)I.I[V]I.NOC1CCCCO1.O=C(NCC1CCN(c2ccc(C(=O)NOC3CCCCO3)cn2)CC1)OCC1c2ccccc2-c2ccccc21.O=C(NCC1CCN(c2ccc(C(=O)O)cn2)CC1)OCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C32H36N4O5.C27H27N3O4.C5H11NO2.I3.5HI.2V/c37-31(35-41-30-11-5-6-18-39-30)23-12-13-29(33-20-23)36-16-14-22(15-17-36)19-34-32(38)40-21-28-26-9-3-1-7-24(26)25-8-2-4-10-27(25)28;31-26(32)19-9-10-25(28-16-19)30-13-11-18(12-14-30)15-29-27(33)34-17-24-22-7-3-1-5-20(22)21-6-2-4-8-23(21)24;6-8-5-3-1-2-4-7-5;1-3-2;;;;;;;/h1-4,7-10,12-13,20,22,28,30H,5-6,11,14-19,21H2,(H,34,38)(H,35,37);1-10,16,18,24H,11-15,17H2,(H,29,33)(H,31,32);5H,1-4,6H2;;5*1H;;/q;;;-1;;;;;;+2;+3/p-5
InChIKeySYWWYWSUAQOGGO-UHFFFAOYSA-I
XLogP13.16
TPSA238.26 Ų
H-Bond Donors5
H-Bond Acceptors15
Rotatable Bonds15
Heavy Atoms93
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002248.46
LogP ≤ 513.16
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide with MolForge

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Related Compounds

9H-fluoren-9-ylmethyl 4-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperazine-1-carboxylate;iodomethane;N-(oxan-2-yloxy)-6-piperazin-1-ylpyridine-3-carboxamide
CID 161006039
6-[4-(9H-fluoren-9-ylmethoxycarbonylamino)piperidin-1-yl]pyridine-3-carboxylic acid
CID 131423946
9H-fluoren-9-ylmethyl 4-[5-(oxan-2-yloxycarbamoyl)pyrimidin-2-yl]piperazine-1-carboxylate
CID 58896211
6-[4-(9H-fluoren-9-ylmethoxycarbonyl)-1,4-diazepan-1-yl]pyridine-3-carboxylic acid
CID 131441818
2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[(6-morpholin-4-ylpyridine-3-carbonyl)amino]hexanoic acid
CID 175464467
N-(cyclohexylmethyl)-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
CID 25182094
methyl 2-[[1-[5-(oxan-2-yloxycarbamoyl)pyrimidin-2-yl]piperidin-4-yl]methylamino]propanoate
CID 59376208
9H-fluoren-9-ylmethyl (2R)-2-amino-4-[[(2S)-oxan-2-yl]oxyamino]-4-oxobutanoate
CID 97106758
N-(oxan-2-yloxy)-2-[4-[4-[2-(2-pyrrolidin-1-ylethoxy)phenyl]phenyl]sulfonylpiperazin-1-yl]pyrimidine-5-carboxamide
CID 58844923
2-[4-[[(5-chloro-2,3-dihydro-1H-indol-3-yl)methylamino]methyl]piperidin-1-yl]-N-(oxan-2-yloxy)pyrimidine-5-carboxamide
CID 88869920
2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(6-morpholin-4-yl-3-pyridinyl)propanoic acid
CID 170882100
2-[3-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]acetic acid
CID 165476394

Frequently Asked Questions

What is the IUPAC name of diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide?
The IUPAC name of diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide (CID 160574245) is diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide.
What is the SMILES notation for diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide?
The canonical SMILES for diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide is I[I-]I.I[V](I)I.I[V]I.NOC1CCCCO1.O=C(NCC1CCN(c2ccc(C(=O)NOC3CCCCO3)cn2)CC1)OCC1c2ccccc2-c2ccccc21.O=C(NCC1CCN(c2ccc(C(=O)O)cn2)CC1)OCC1c2ccccc2-c2ccccc21.
What is the InChIKey of diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide?
The InChIKey is SYWWYWSUAQOGGO-UHFFFAOYSA-I. The full InChI is InChI=1S/C32H36N4O5.C27H27N3O4.C5H11NO2.I3.5HI.2V/c37-31(35-41-30-11-5-6-18-39-30)23-12-13-29(33-20-23)36-16-14-22(15-17-36)19-34-32(38)40-21-28-26-9-3-1-7-24(26)25-8-2-4-10-27(25)28;31-26(32)19-9-10-25(28-16-19)30-13-11-18(12-14-30)15-29-27(33)34-17-24-22-7-3-1-5-20(22)21-6-2-4-8-23(21)24;6-8-5-3-1-2-4-7-5;1-3-2;;;;;;;/h1-4,7-10,12-13,20,22,28,30H,5-6,11,14-19,21H2,(H,34,38)(H,35,37);1-10,16,18,24H,11-15,17H2,(H,29,33)(H,31,32);5H,1-4,6H2;;5*1H;;/q;;;-1;;;;;;+2;+3/p-5.
What are the key properties of diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide?
diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide has a molecular weight of 2248.46 g/mol, XLogP of 13.16, 15 rotatable bonds, 5 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for diiodovanadium;6-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]piperidin-1-yl]pyridine-3-carboxylic acid;9H-fluoren-9-ylmethyl N-[[1-[5-(oxan-2-yloxycarbamoyl)-2-pyridinyl]piperidin-4-yl]methyl]carbamate;O-(oxan-2-yl)hydroxylamine;triiodovanadium;triiodide is sourced from PubChem (CID 160574245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).