difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+)

C22H28F5N3U — CID 167492539

About difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+)

difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+) (PubChem CID 167492539) has the molecular formula C22H28F5N3U and a molecular weight of 667.51 g/mol. Its IUPAC name is difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+).

Molecular Properties

• Compound Name: difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+)
• PubChem CID: 167492539
• Molecular Formula: C22H28F5N3U
• Molecular Weight: 667.51 g/mol
• Exact Mass: 667.27
• IUPAC Name: difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+)
• SMILES: CC/C=N/C=C(C)/C(=N\C/C=C(\C)NCCC)c1[c-]cc(C(F)(F)F)cc1.F[CH-]F.[U+2]
• InChI: InChI=1S/C21H27F3N3.CHF2.U/c1-5-12-25-15-16(3)20(27-14-11-17(4)26-13-6-2)18-7-9-19(10-8-18)21(22,23)24;2-1-3;/h7,9-12,15,26H,5-6,13-14H2,1-4H3;1H;/q2*-1;+2/b16-15+,17-11+,25-12+,27-20+
• InChIKey: ICQLOFVGLJFNKU-LSAJBETPSA-N
• XLogP: 6.63
• TPSA: 36.75 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 9
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	667.51
LogP ≤ 5	6.63
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+)?

The IUPAC name of difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+) (CID 167492539) is difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+).

What is the SMILES notation for difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+)?

The canonical SMILES for difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+) is CC/C=N/C=C(C)/C(=N\C/C=C(\C)NCCC)c1[c-]cc(C(F)(F)F)cc1.F[CH-]F.[U+2].

What is the InChIKey of difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+)?

The InChIKey is ICQLOFVGLJFNKU-LSAJBETPSA-N. The full InChI is InChI=1S/C21H27F3N3.CHF2.U/c1-5-12-25-15-16(3)20(27-14-11-17(4)26-13-6-2)18-7-9-19(10-8-18)21(22,23)24;2-1-3;/h7,9-12,15,26H,5-6,13-14H2,1-4H3;1H;/q2*-1;+2/b16-15+,17-11+,25-12+,27-20+;;.

What are the key properties of difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+)?

difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+) has a molecular weight of 667.51 g/mol, XLogP of 6.63, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for difluoromethane;(E)-4-[[(E)-2-methyl-3-(propylideneamino)-1-[4-(trifluoromethyl)benzene-6-id-1-yl]prop-2-enylidene]amino]-N-propylbut-2-en-2-amine;uranium(2+) is sourced from PubChem (CID 167492539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).