[[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium

C6H14N3Re- — CID 177246585

IUPAC[[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium
SMILESCC(N)/C=C\C(C)N[NH-].[Re]
InChIInChI=1S/C6H14N3.Re/c1-5(7)3-4-6(2)9-8;/h3-6,8-9H,7H2,1-2H3;/q-1;/b4-3-;
InChIKeyTUJOMSPIFHTKNC-LNKPDPKZSA-N
MW314.41 g/mol
LogP0.83
Rot. Bonds3

About [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium

[[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium (PubChem CID 177246585) has the molecular formula C6H14N3Re- and a molecular weight of 314.41 g/mol. Its IUPAC name is [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium.

Molecular Properties

Compound Name[[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium
PubChem CID177246585
Molecular FormulaC6H14N3Re-
Molecular Weight314.41 g/mol
Exact Mass315.08
IUPAC Name[[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium
SMILESCC(N)/C=C\C(C)N[NH-].[Re]
InChIInChI=1S/C6H14N3.Re/c1-5(7)3-4-6(2)9-8;/h3-6,8-9H,7H2,1-2H3;/q-1;/b4-3-;
InChIKeyTUJOMSPIFHTKNC-LNKPDPKZSA-N
XLogP0.83
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.41
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-5-methylhex-3-en-2-amine
CID 103668442
(E)-pent-3-en-2-amine
CID 13149669
(E)-3-aminobut-1-ene-1-thiol;methylhydrazine
CID 144517889
methyl (E,2S,5S)-5-amino-2-methoxyhex-3-enoate
CID 10773554
(3Z,5Z)-hepta-3,5-dien-2-amine
CID 139386653
(2S)-2-amino-1-deuteriopropan-1-one
CID 57165774
(E)-hex-3-en-2-amine;hydrochloride
CID 55289622
methyl (4S)-4-aminopent-2-enoate
CID 91583994
4-aminopent-2-enamide
CID 90746791
(Z,2S)-4-methylsulfonylbut-3-en-2-amine
CID 170718426
(2S)-but-3-en-2-amine
CID 10034575
ethyl (Z)-2,5-diaminohex-3-enoate
CID 154468821

Frequently Asked Questions

What is the IUPAC name of [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium?
The IUPAC name of [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium (CID 177246585) is [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium.
What is the SMILES notation for [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium?
The canonical SMILES for [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium is CC(N)/C=C\C(C)N[NH-].[Re].
What is the InChIKey of [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium?
The InChIKey is TUJOMSPIFHTKNC-LNKPDPKZSA-N. The full InChI is InChI=1S/C6H14N3.Re/c1-5(7)3-4-6(2)9-8;/h3-6,8-9H,7H2,1-2H3;/q-1;/b4-3-;.
What are the key properties of [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium?
[[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium has a molecular weight of 314.41 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [[(Z)-5-aminohex-3-en-2-yl]amino]azanide;rhenium is sourced from PubChem (CID 177246585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).