chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)

C38H39ClN7OOs — CID 59841645

IUPACchloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)
SMILESCC(CC(CC(C)c1ccncc1)c1ccncc1)C(N)=O.Cl[Os].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C18H23N3O.2C10H8N2.ClH.Os/c1-13(15-3-7-20-8-4-15)11-17(12-14(2)18(19)22)16-5-9-21-10-6-16;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;/h3-10,13-14,17H,11-12H2,1-2H3,(H2,19,22);2*1-8H;1H;/q;;;;+1/p-1
InChIKeyPMKINOFNLZDDAT-UHFFFAOYSA-M
MW835.46 g/mol
LogP8.24
Rot. Bonds9

About chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)

chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine) (PubChem CID 59841645) has the molecular formula C38H39ClN7OOs and a molecular weight of 835.46 g/mol. Its IUPAC name is chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine).

Molecular Properties

Compound Namechloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)
PubChem CID59841645
Molecular FormulaC38H39ClN7OOs
Molecular Weight835.46 g/mol
Exact Mass836.25
IUPAC Namechloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)
SMILESCC(CC(CC(C)c1ccncc1)c1ccncc1)C(N)=O.Cl[Os].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C18H23N3O.2C10H8N2.ClH.Os/c1-13(15-3-7-20-8-4-15)11-17(12-14(2)18(19)22)16-5-9-21-10-6-16;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;/h3-10,13-14,17H,11-12H2,1-2H3,(H2,19,22);2*1-8H;1H;/q;;;;+1/p-1
InChIKeyPMKINOFNLZDDAT-UHFFFAOYSA-M
XLogP8.24
TPSA120.43 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500835.46
LogP ≤ 58.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine) with MolForge

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Related Compounds

4-(2,6-diphenyloctan-4-yl)pyridine;methane
CID 157478380
4-(1-ethyl-3-pyridin-4-ylbutyl)pyridine
CID 18346387
4-pyren-1-ylbutyl 2-methyl-4-phenyl-6-pyridin-4-ylheptanoate
CID 123597852
4-pyridin-4-ylpentan-2-amine
CID 112714269
2-[[(1S)-1-pyridin-4-ylethyl]amino]butanamide
CID 81409606
propane;2-pyridin-2-ylpyridine
CID 158168510
bis(pyridin-4-amine);bis(2-pyridin-2-ylpyridine);ruthenium(2+);dichloride
CID 11422486
pyridin-4-amine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);dichloride
CID 11180709
(2S)-2-methyl-1-(3-pyridin-2-ylpyrazol-1-yl)pentan-1-one
CID 102416543
calcium;3-acetylpentane-2,4-dione;hydride;2-pyridin-2-ylpyridine
CID 173092020
2-pyridin-4-ylbutanamide
CID 67405148
3-[4-(7-phenyl-5-pyridin-4-yloctan-3-yl)pyridin-1-ium-1-yl]propane-1-sulfonic acid
CID 20823483

Frequently Asked Questions

What is the IUPAC name of chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)?
The IUPAC name of chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine) (CID 59841645) is chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine).
What is the SMILES notation for chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)?
The canonical SMILES for chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine) is CC(CC(CC(C)c1ccncc1)c1ccncc1)C(N)=O.Cl[Os].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)?
The InChIKey is PMKINOFNLZDDAT-UHFFFAOYSA-M. The full InChI is InChI=1S/C18H23N3O.2C10H8N2.ClH.Os/c1-13(15-3-7-20-8-4-15)11-17(12-14(2)18(19)22)16-5-9-21-10-6-16;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;/h3-10,13-14,17H,11-12H2,1-2H3,(H2,19,22);2*1-8H;1H;/q;;;;+1/p-1.
What are the key properties of chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine)?
chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine) has a molecular weight of 835.46 g/mol, XLogP of 8.24, 9 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for chloroosmium;2-methyl-4,6-dipyridin-4-ylheptanamide;bis(2-pyridin-2-ylpyridine) is sourced from PubChem (CID 59841645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).