chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)

C30H35ClN7O4Os — CID 59575067

IUPACchloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)
SMILESCOc1ccnc(-c2cc(OC)ccn2)c1.COc1ccnc(-c2cc(OC)ccn2)c1.Cl[Os].NCCCn1ccnc1
InChIInChI=1S/2C12H12N2O2.C6H11N3.ClH.Os/c2*1-15-9-3-5-13-11(7-9)12-8-10(16-2)4-6-14-12;7-2-1-4-9-5-3-8-6-9;;/h2*3-8H,1-2H3;3,5-6H,1-2,4,7H2;1H;/q;;;;+1/p-1
InChIKeyJYIFAYBMGHXCMS-UHFFFAOYSA-M
MW783.34 g/mol
LogP5.24
Rot. Bonds9

About chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)

chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine) (PubChem CID 59575067) has the molecular formula C30H35ClN7O4Os and a molecular weight of 783.34 g/mol. Its IUPAC name is chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine).

Molecular Properties

Compound Namechloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)
PubChem CID59575067
Molecular FormulaC30H35ClN7O4Os
Molecular Weight783.34 g/mol
Exact Mass784.21
IUPAC Namechloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)
SMILESCOc1ccnc(-c2cc(OC)ccn2)c1.COc1ccnc(-c2cc(OC)ccn2)c1.Cl[Os].NCCCn1ccnc1
InChIInChI=1S/2C12H12N2O2.C6H11N3.ClH.Os/c2*1-15-9-3-5-13-11(7-9)12-8-10(16-2)4-6-14-12;7-2-1-4-9-5-3-8-6-9;;/h2*3-8H,1-2H3;3,5-6H,1-2,4,7H2;1H;/q;;;;+1/p-1
InChIKeyJYIFAYBMGHXCMS-UHFFFAOYSA-M
XLogP5.24
TPSA132.32 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds9
Heavy Atoms43
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500783.34
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

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Related Compounds

chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(2-pyridin-2-ylpyridine)
CID 11585550
3-imidazol-1-ylpropan-1-amine;hydrochloride
CID 19864194
1-[6-(3-methoxyphenoxy)hexyl]imidazole
CID 3758429
1-[7-(2-chloro-4-methoxyphenoxy)heptyl]imidazole
CID 19378833
1-[5-(2-chloro-4-methoxyphenoxy)pentyl]imidazole
CID 18921807
2-[2-(2-imidazol-1-ylethoxy)-5-methoxyphenyl]ethanamine
CID 54931279
2-(2-fluoro-5-methoxyphenyl)-1-(3-imidazol-1-ylpropyl)imidazole
CID 56760532
1-[2-(3-imidazol-1-ylpropoxy)-4-methoxyphenyl]ethanone
CID 82001062
1-[2-(4-methoxyphenoxy)ethyl]imidazole
CID 868397
1-[2-(3-imidazol-1-ylpropoxy)-4-methoxyphenyl]ethanol
CID 82001092
1-[4-(4-chlorophenoxy)butyl]imidazole
CID 2843495
1-(2-chloro-4-methoxyphenyl)-6-imidazol-1-ylhexan-1-ol
CID 18921898

Frequently Asked Questions

What is the IUPAC name of chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)?
The IUPAC name of chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine) (CID 59575067) is chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine).
What is the SMILES notation for chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)?
The canonical SMILES for chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine) is COc1ccnc(-c2cc(OC)ccn2)c1.COc1ccnc(-c2cc(OC)ccn2)c1.Cl[Os].NCCCn1ccnc1.
What is the InChIKey of chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)?
The InChIKey is JYIFAYBMGHXCMS-UHFFFAOYSA-M. The full InChI is InChI=1S/2C12H12N2O2.C6H11N3.ClH.Os/c2*1-15-9-3-5-13-11(7-9)12-8-10(16-2)4-6-14-12;7-2-1-4-9-5-3-8-6-9;;/h2*3-8H,1-2H3;3,5-6H,1-2,4,7H2;1H;/q;;;;+1/p-1.
What are the key properties of chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine)?
chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine) has a molecular weight of 783.34 g/mol, XLogP of 5.24, 9 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for chloroosmium;3-imidazol-1-ylpropan-1-amine;bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine) is sourced from PubChem (CID 59575067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).