ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)

C10H19N3OU — CID 163554947

IUPACethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)
SMILESCCNC1C=C(N)[C-]=C(N)C1.[CH2-]CO.[U+2]
InChIInChI=1S/C8H14N3.C2H5O.U/c1-2-11-8-4-6(9)3-7(10)5-8;1-2-3;/h4,8,11H,2,5,9-10H2,1H3;3H,1-2H2;/q2*-1;+2
InChIKeyHWZVXSXQJXRZPQ-UHFFFAOYSA-N
MW435.31 g/mol
LogP-0.33
Rot. Bonds2

About ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)

ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+) (PubChem CID 163554947) has the molecular formula C10H19N3OU and a molecular weight of 435.31 g/mol. Its IUPAC name is ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+).

Molecular Properties

Compound Nameethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)
PubChem CID163554947
Molecular FormulaC10H19N3OU
Molecular Weight435.31 g/mol
Exact Mass435.20
IUPAC Nameethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)
SMILESCCNC1C=C(N)[C-]=C(N)C1.[CH2-]CO.[U+2]
InChIInChI=1S/C8H14N3.C2H5O.U/c1-2-11-8-4-6(9)3-7(10)5-8;1-2-3;/h4,8,11H,2,5,9-10H2,1H3;3H,1-2H2;/q2*-1;+2
InChIKeyHWZVXSXQJXRZPQ-UHFFFAOYSA-N
XLogP-0.33
TPSA84.30 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.31
LogP ≤ 5-0.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(5-Aminocyclohexa-1,3-dien-1-yl)amino]ethanol
CID 21525076
2-[2-(1,2-Dihydropyridin-2-yl)ethylamino]ethanol
CID 67600219
2-[(4-Aminocyclohexa-2,4-dien-1-yl)amino]ethanol
CID 163968274

Frequently Asked Questions

What is the IUPAC name of ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)?
The IUPAC name of ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+) (CID 163554947) is ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+).
What is the SMILES notation for ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)?
The canonical SMILES for ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+) is CCNC1C=C(N)[C-]=C(N)C1.[CH2-]CO.[U+2].
What is the InChIKey of ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)?
The InChIKey is HWZVXSXQJXRZPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N3.C2H5O.U/c1-2-11-8-4-6(9)3-7(10)5-8;1-2-3;/h4,8,11H,2,5,9-10H2,1H3;3H,1-2H2;/q2*-1;+2.
What are the key properties of ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+)?
ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+) has a molecular weight of 435.31 g/mol, XLogP of -0.33, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;5-N-ethylcyclohexa-1,3-diene-1,3,5-triamine;uranium(2+) is sourced from PubChem (CID 163554947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).