chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)

C77H117Cl5N14O7Os4P3Ru3-14 — CID 162303272

IUPACchloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)
SMILESCC(C)[PH+](CC[N-]Cc1ccccn1)C(C)C.C[CH-]C.Cl[Os].Cl[Os].Cl[Ru].Cl[Ru].Cl[Ru].PPCC[N-]Cc1ccccn1.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[Os].[Os]
InChIInChI=1S/C14H24N2P.5C9H13N2.C8H13N2P2.C3H7.7CHO.5ClH.4Os.3Ru/c1-12(2)17(13(3)4)10-9-15-11-14-7-5-6-8-16-14;5*1-2-6-10-8-9-5-3-4-7-11-9;11-12-6-5-9-7-8-3-1-2-4-10-8;1-3-2;7*1-2;;;;;;;;;;;;/h5-8,12-13H,9-11H2,1-4H3;5*3-5,7,10H,1-2,6,8H2;1-4,12H,5-7,11H2;3H,1-2H3;7*1H;5*1H;;;;;;;/q15*-1;;;;;;;;5*+1/p-4
InChIKeyQCUSWIHTMADGRM-UHFFFAOYSA-J
MW2685.19 g/mol
LogP16.13
Rot. Bonds32

About chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)

chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine) (PubChem CID 162303272) has the molecular formula C77H117Cl5N14O7Os4P3Ru3-14 and a molecular weight of 2685.19 g/mol. Its IUPAC name is chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine).

Molecular Properties

Compound Namechloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)
PubChem CID162303272
Molecular FormulaC77H117Cl5N14O7Os4P3Ru3-14
Molecular Weight2685.19 g/mol
Exact Mass2691.26
IUPAC Namechloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)
SMILESCC(C)[PH+](CC[N-]Cc1ccccn1)C(C)C.C[CH-]C.Cl[Os].Cl[Os].Cl[Ru].Cl[Ru].Cl[Ru].PPCC[N-]Cc1ccccn1.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[Os].[Os]
InChIInChI=1S/C14H24N2P.5C9H13N2.C8H13N2P2.C3H7.7CHO.5ClH.4Os.3Ru/c1-12(2)17(13(3)4)10-9-15-11-14-7-5-6-8-16-14;5*1-2-6-10-8-9-5-3-4-7-11-9;11-12-6-5-9-7-8-3-1-2-4-10-8;1-3-2;7*1-2;;;;;;;;;;;;/h5-8,12-13H,9-11H2,1-4H3;5*3-5,7,10H,1-2,6,8H2;1-4,12H,5-7,11H2;3H,1-2H3;7*1H;5*1H;;;;;;;/q15*-1;;;;;;;;5*+1/p-4
InChIKeyQCUSWIHTMADGRM-UHFFFAOYSA-J
XLogP16.13
TPSA298.07 Ų
H-Bond Donors5
H-Bond Acceptors19
Rotatable Bonds32
Heavy Atoms113
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002685.19
LogP ≤ 516.13
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine) with MolForge

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Related Compounds

chloro(hydrido)osmium;methanone;N-(pyridin-2-ylmethyl)propan-1-amine
CID 162303268
N'-(pyridin-2-ylmethyl)-N-[2-(pyridin-2-ylmethylamino)ethyl]ethane-1,2-diamine
CID 12029921
2-methylsulfinyl-N-(pyridin-2-ylmethyl)ethanamine
CID 115632570
zinc;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;dihydrochloride
CID 73345757
3-bromo-N-(pyridin-2-ylmethyl)propan-1-amine
CID 114293539
2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine;hydrochloride
CID 17332283
4-pyridin-2-yl-N-(pyridin-2-ylmethyl)butan-1-amine
CID 158855450
4,4,4-trifluoro-N-(pyridin-2-ylmethyl)butan-1-amine
CID 79039082
2-butan-2-yloxy-N-(pyridin-2-ylmethyl)ethanamine
CID 62583986
ethanamine;N-(pyridin-2-ylmethyl)propan-1-amine
CID 144892285
(Z)-3-chloro-2-methyl-N-(pyridin-2-ylmethyl)prop-2-en-1-amine
CID 106437387
N-benzyl-N'-(pyridin-2-ylmethyl)ethane-1,2-diamine
CID 90740224

Frequently Asked Questions

What is the IUPAC name of chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)?
The IUPAC name of chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine) (CID 162303272) is chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine).
What is the SMILES notation for chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)?
The canonical SMILES for chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine) is CC(C)[PH+](CC[N-]Cc1ccccn1)C(C)C.C[CH-]C.Cl[Os].Cl[Os].Cl[Ru].Cl[Ru].Cl[Ru].PPCC[N-]Cc1ccccn1.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[CH2-]CCNCc1ccccn1.[Os].[Os].
What is the InChIKey of chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)?
The InChIKey is QCUSWIHTMADGRM-UHFFFAOYSA-J. The full InChI is InChI=1S/C14H24N2P.5C9H13N2.C8H13N2P2.C3H7.7CHO.5ClH.4Os.3Ru/c1-12(2)17(13(3)4)10-9-15-11-14-7-5-6-8-16-14;5*1-2-6-10-8-9-5-3-4-7-11-9;11-12-6-5-9-7-8-3-1-2-4-10-8;1-3-2;7*1-2;;;;;;;;;;;;/h5-8,12-13H,9-11H2,1-4H3;5*3-5,7,10H,1-2,6,8H2;1-4,12H,5-7,11H2;3H,1-2H3;7*1H;5*1H;;;;;;;/q15*-1;;;;;;;;5*+1/p-4.
What are the key properties of chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine)?
chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine) has a molecular weight of 2685.19 g/mol, XLogP of 16.13, 32 rotatable bonds, 5 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(hydrido)osmium;chloro(hydrido)ruthenium;2-(diphosphanyl)ethyl-(pyridin-2-ylmethyl)azanide;2-di(propan-2-yl)phosphaniumylethyl-(pyridin-2-ylmethyl)azanide;methanone;osmium monohydride;propane;pentakis(N-(pyridin-2-ylmethyl)propan-1-amine) is sourced from PubChem (CID 162303272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).