azane;cobalt;1H-imidazole-2-carboxylic acid

C4H7CoN3O2 — CID 175883152

IUPACazane;cobalt;1H-imidazole-2-carboxylic acid
SMILESN.O=C(O)c1ncc[nH]1.[Co]
InChIInChI=1S/C4H4N2O2.Co.H3N/c7-4(8)3-5-1-2-6-3;;/h1-2H,(H,5,6)(H,7,8);;1H3
InChIKeyYYNWZWTZJKLVFH-UHFFFAOYSA-N
MW188.05 g/mol
LogP0.27
Rot. Bonds1

About azane;cobalt;1H-imidazole-2-carboxylic acid

azane;cobalt;1H-imidazole-2-carboxylic acid (PubChem CID 175883152) has the molecular formula C4H7CoN3O2 and a molecular weight of 188.05 g/mol. Its IUPAC name is azane;cobalt;1H-imidazole-2-carboxylic acid.

Molecular Properties

Compound Nameazane;cobalt;1H-imidazole-2-carboxylic acid
PubChem CID175883152
Molecular FormulaC4H7CoN3O2
Molecular Weight188.05 g/mol
Exact Mass187.99
IUPAC Nameazane;cobalt;1H-imidazole-2-carboxylic acid
SMILESN.O=C(O)c1ncc[nH]1.[Co]
InChIInChI=1S/C4H4N2O2.Co.H3N/c7-4(8)3-5-1-2-6-3;;/h1-2H,(H,5,6)(H,7,8);;1H3
InChIKeyYYNWZWTZJKLVFH-UHFFFAOYSA-N
XLogP0.27
TPSA100.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.05
LogP ≤ 50.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 173201174
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CID 68543177
bis(1H-imidazol-2-yl)methanethione
CID 11412697
1-(1H-imidazole-2-carbonyl)piperidine-2-carboxylic acid
CID 110466478
2-(1H-imidazole-2-carbonyl)-3-methylbutanoic acid
CID 69336680
(Z)-3-amino-1-(1H-imidazol-2-yl)prop-2-en-1-one
CID 142610359
3-chloro-1-(1H-imidazol-2-yl)propan-1-one
CID 19700809
2-(hydroxymethyl)-1-(1H-imidazol-2-yl)but-3-en-1-one
CID 19018083
3,4,5,6-tetrahydroxy-1,8-bis(1H-imidazol-2-yl)octane-1,2,7,8-tetrone
CID 22008153
1H-imidazol-2-yl(1H-1,2,4-triazol-5-yl)methanone
CID 57179658
1H-imidazole-2-carbothioamide
CID 18521648

Frequently Asked Questions

What is the IUPAC name of azane;cobalt;1H-imidazole-2-carboxylic acid?
The IUPAC name of azane;cobalt;1H-imidazole-2-carboxylic acid (CID 175883152) is azane;cobalt;1H-imidazole-2-carboxylic acid.
What is the SMILES notation for azane;cobalt;1H-imidazole-2-carboxylic acid?
The canonical SMILES for azane;cobalt;1H-imidazole-2-carboxylic acid is N.O=C(O)c1ncc[nH]1.[Co].
What is the InChIKey of azane;cobalt;1H-imidazole-2-carboxylic acid?
The InChIKey is YYNWZWTZJKLVFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2O2.Co.H3N/c7-4(8)3-5-1-2-6-3;;/h1-2H,(H,5,6)(H,7,8);;1H3.
What are the key properties of azane;cobalt;1H-imidazole-2-carboxylic acid?
azane;cobalt;1H-imidazole-2-carboxylic acid has a molecular weight of 188.05 g/mol, XLogP of 0.27, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;cobalt;1H-imidazole-2-carboxylic acid is sourced from PubChem (CID 175883152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).