(Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine

C15H32As2N2 — CID 162405267

IUPAC(Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine
SMILESC/C(=C/C(C)=N/CCC[As](C)C)NCCC[As](C)C
InChIInChI=1S/C15H32As2N2/c1-14(18-11-7-9-16(3)4)13-15(2)19-12-8-10-17(5)6/h13,18H,7-12H2,1-6H3/b14-13-,19-15+
InChIKeyVWQSAKKPELUNSG-GCYSJDCNSA-N
MW390.28 g/mol
LogP4.23
Rot. Bonds10

About (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine

(Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine (PubChem CID 162405267) has the molecular formula C15H32As2N2 and a molecular weight of 390.28 g/mol. Its IUPAC name is (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine
PubChem CID162405267
Molecular FormulaC15H32As2N2
Molecular Weight390.28 g/mol
Exact Mass390.10
IUPAC Name(Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine
SMILESC/C(=C/C(C)=N/CCC[As](C)C)NCCC[As](C)C
InChIInChI=1S/C15H32As2N2/c1-14(18-11-7-9-16(3)4)13-15(2)19-12-8-10-17(5)6/h13,18H,7-12H2,1-6H3/b14-13-,19-15+
InChIKeyVWQSAKKPELUNSG-GCYSJDCNSA-N
XLogP4.23
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.28
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine?
The IUPAC name of (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine (CID 162405267) is (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine.
What is the SMILES notation for (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine?
The canonical SMILES for (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine is C/C(=C/C(C)=N/CCC[As](C)C)NCCC[As](C)C.
What is the InChIKey of (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine?
The InChIKey is VWQSAKKPELUNSG-GCYSJDCNSA-N. The full InChI is InChI=1S/C15H32As2N2/c1-14(18-11-7-9-16(3)4)13-15(2)19-12-8-10-17(5)6/h13,18H,7-12H2,1-6H3/b14-13-,19-15+.
What are the key properties of (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine?
(Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine has a molecular weight of 390.28 g/mol, XLogP of 4.23, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(3-dimethylarsanylpropyl)-4-(3-dimethylarsanylpropylimino)pent-2-en-2-amine is sourced from PubChem (CID 162405267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).