carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium)

C34H49ClI3N15O5V4-4 — CID 157426879

About carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium)

carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium) (PubChem CID 157426879) has the molecular formula C34H49ClI3N15O5V4-4 and a molecular weight of 1367.81 g/mol. Its IUPAC name is carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium).

Molecular Properties

• Compound Name: carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium)
• PubChem CID: 157426879
• Molecular Formula: C34H49ClI3N15O5V4-4
• Molecular Weight: 1367.81 g/mol
• Exact Mass: 1366.86
• IUPAC Name: carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium)
• SMILES: C.CO.Cc1cn(-c2ccnc(N)c2N)cn1.Cc1cn(-c2ccnc(N)c2[N+](=O)[O-])cn1.Cc1cnc[nH]1.I[CH-]I.Nc1nccc(Cl)c1[N+](=O)[O-].[CH2-]C.[CH2-]I.[CH3-].[V].[V].[V].[V]
• InChI: InChI=1S/C9H9N5O2.C9H11N5.C5H4ClN3O2.C4H6N2.C2H5.CHI2.CH2I.CH4O.CH4.CH3.4V/c1-6-4-13(5-12-6)7-2-3-11-9(10)8(7)14(15)16;1-6-4-14(5-13-6)7-2-3-12-9(11)8(7)10;6-3-1-2-8-5(7)4(3)9(10)11;1-4-2-5-3-6-4;1-2;2-1-3;2*1-2;;;;;;/h2-5H,1H3,(H2,10,11);2-5H,10H2,1H3,(H2,11,12);1-2H,(H2,7,8);2-3H,1H3,(H,5,6);1H2,2H3;1H;1H2;2H,1H3;1H4;1H3;;;;/q;;;;3*-1;;;-1
• InChIKey: IFWOBNDIBVAZTH-UHFFFAOYSA-N
• XLogP: 8.46
• TPSA: 313.58 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 17
• Rotatable Bonds: 4
• Heavy Atoms: 62
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1367.81
LogP ≤ 5	8.46
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium)?

The IUPAC name of carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium) (CID 157426879) is carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium).

What is the SMILES notation for carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium)?

The canonical SMILES for carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium) is C.CO.Cc1cn(-c2ccnc(N)c2N)cn1.Cc1cn(-c2ccnc(N)c2[N+](=O)[O-])cn1.Cc1cnc[nH]1.I[CH-]I.Nc1nccc(Cl)c1[N+](=O)[O-].[CH2-]C.[CH2-]I.[CH3-].[V].[V].[V].[V].

What is the InChIKey of carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium)?

The InChIKey is IFWOBNDIBVAZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5O2.C9H11N5.C5H4ClN3O2.C4H6N2.C2H5.CHI2.CH2I.CH4O.CH4.CH3.4V/c1-6-4-13(5-12-6)7-2-3-11-9(10)8(7)14(15)16;1-6-4-14(5-13-6)7-2-3-12-9(11)8(7)10;6-3-1-2-8-5(7)4(3)9(10)11;1-4-2-5-3-6-4;1-2;2-1-3;2*1-2;;;;;;/h2-5H,1H3,(H2,10,11);2-5H,10H2,1H3,(H2,11,12);1-2H,(H2,7,8);2-3H,1H3,(H,5,6);1H2,2H3;1H;1H2;2H,1H3;1H4;1H3;;;;/q;;;;3*-1;;;-1;;;;.

What are the key properties of carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium)?

carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium) has a molecular weight of 1367.81 g/mol, XLogP of 8.46, 4 rotatable bonds, 6 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for carbanide;4-chloro-3-nitropyridin-2-amine;diiodomethane;ethane;iodomethane;methane;methanol;5-methyl-1H-imidazole;4-(4-methylimidazol-1-yl)-3-nitropyridin-2-amine;4-(4-methylimidazol-1-yl)pyridine-2,3-diamine;tetrakis(vanadium) is sourced from PubChem (CID 157426879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).