(Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine

C13H28NP — CID 126755705

IUPAC(Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine
SMILESCP[C@H](/C=C\C(C)CCCC(C)C)CN
InChIInChI=1S/C13H28NP/c1-11(2)6-5-7-12(3)8-9-13(10-14)15-4/h8-9,11-13,15H,5-7,10,14H2,1-4H3/b9-8-/t12?,13-/m1/s1
InChIKeyZSAOWYPXKQPLQJ-LMROZPDVSA-N
MW229.35 g/mol
LogP3.64
Rot. Bonds8

About (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine

(Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine (PubChem CID 126755705) has the molecular formula C13H28NP and a molecular weight of 229.35 g/mol. Its IUPAC name is (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine.

Molecular Properties

Compound Name(Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine
PubChem CID126755705
Molecular FormulaC13H28NP
Molecular Weight229.35 g/mol
Exact Mass229.20
IUPAC Name(Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine
SMILESCP[C@H](/C=C\C(C)CCCC(C)C)CN
InChIInChI=1S/C13H28NP/c1-11(2)6-5-7-12(3)8-9-13(10-14)15-4/h8-9,11-13,15H,5-7,10,14H2,1-4H3/b9-8-/t12?,13-/m1/s1
InChIKeyZSAOWYPXKQPLQJ-LMROZPDVSA-N
XLogP3.64
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine?
The IUPAC name of (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine (CID 126755705) is (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine.
What is the SMILES notation for (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine?
The canonical SMILES for (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine is CP[C@H](/C=C\C(C)CCCC(C)C)CN.
What is the InChIKey of (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine?
The InChIKey is ZSAOWYPXKQPLQJ-LMROZPDVSA-N. The full InChI is InChI=1S/C13H28NP/c1-11(2)6-5-7-12(3)8-9-13(10-14)15-4/h8-9,11-13,15H,5-7,10,14H2,1-4H3/b9-8-/t12?,13-/m1/s1.
What are the key properties of (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine?
(Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine has a molecular weight of 229.35 g/mol, XLogP of 3.64, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2R)-5,9-dimethyl-2-methylphosphanyldec-3-en-1-amine is sourced from PubChem (CID 126755705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).