cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)

C22H18CoN6O4 — CID 10885414

IUPACcobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)
SMILESO=C(N/N=C/c1ccco1)c1ccncc1.O=C(N/N=C/c1ccco1)c1ccncc1.[Co]
InChIInChI=1S/2C11H9N3O2.Co/c2*15-11(9-3-5-12-6-4-9)14-13-8-10-2-1-7-16-10;/h2*1-8H,(H,14,15);/b2*13-8+;
InChIKeyKYRHJRLNZXHWRT-INMZZCFLSA-N
MW489.36 g/mol
LogP2.87
Rot. Bonds6

About cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)

cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide) (PubChem CID 10885414) has the molecular formula C22H18CoN6O4 and a molecular weight of 489.36 g/mol. Its IUPAC name is cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide).

Molecular Properties

Compound Namecobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)
PubChem CID10885414
Molecular FormulaC22H18CoN6O4
Molecular Weight489.36 g/mol
Exact Mass489.07
IUPAC Namecobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)
SMILESO=C(N/N=C/c1ccco1)c1ccncc1.O=C(N/N=C/c1ccco1)c1ccncc1.[Co]
InChIInChI=1S/2C11H9N3O2.Co/c2*15-11(9-3-5-12-6-4-9)14-13-8-10-2-1-7-16-10;/h2*1-8H,(H,14,15);/b2*13-8+;
InChIKeyKYRHJRLNZXHWRT-INMZZCFLSA-N
XLogP2.87
TPSA134.98 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.36
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[3-(furan-2-yl)prop-2-enylideneamino]pyridine-4-carboxamide
CID 2853290
N-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]pyridine-4-carboxamide
CID 6893827
N-[(Z)-furan-2-ylmethylideneamino]-4-methylbenzamide
CID 5402801
3,4-dichloro-N-(furan-2-ylmethylideneamino)benzamide
CID 4991897
N-[(Z)-furan-2-ylmethylideneamino]-4-methoxybenzamide
CID 5372129
5-bromo-N-(furan-2-ylmethylideneamino)pyridine-3-carboxamide
CID 3599810
N-[(E)-furan-2-ylmethylideneamino]-4-phenoxybenzamide
CID 166606480
N-[(E)-(5-aminofuran-2-yl)methylideneamino]pyridine-4-carboxamide
CID 170219541
N-(furan-2-ylmethylideneamino)-1H-pyrazole-5-carboxamide
CID 768290
3-fluoro-N-[(E)-furan-2-ylmethylideneamino]benzamide
CID 6895117
N-(furan-2-ylmethylideneamino)naphthalene-2-carboxamide
CID 67077074
[(E)-furan-2-ylmethylideneamino]carbamic acid
CID 23219991

Frequently Asked Questions

What is the IUPAC name of cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)?
The IUPAC name of cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide) (CID 10885414) is cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide).
What is the SMILES notation for cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)?
The canonical SMILES for cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide) is O=C(N/N=C/c1ccco1)c1ccncc1.O=C(N/N=C/c1ccco1)c1ccncc1.[Co].
What is the InChIKey of cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)?
The InChIKey is KYRHJRLNZXHWRT-INMZZCFLSA-N. The full InChI is InChI=1S/2C11H9N3O2.Co/c2*15-11(9-3-5-12-6-4-9)14-13-8-10-2-1-7-16-10;/h2*1-8H,(H,14,15);/b2*13-8+;.
What are the key properties of cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide)?
cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide) has a molecular weight of 489.36 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;bis(N-[(E)-furan-2-ylmethylideneamino]pyridine-4-carboxamide) is sourced from PubChem (CID 10885414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).