(E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine

C15H31N — CID 89116873

IUPAC(E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine
SMILESC/C(N)=C(/C)C(C)C(C)C(C)C(C)C(C)C
InChIInChI=1S/C15H31N/c1-9(2)10(3)11(4)12(5)13(6)14(7)15(8)16/h9-13H,16H2,1-8H3/b15-14+
InChIKeyLKAPRAWPUSWNCX-CCEZHUSRSA-N
MW225.42 g/mol
LogP4.44
Rot. Bonds5

About (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine

(E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine (PubChem CID 89116873) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine.

Molecular Properties

Compound Name(E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine
PubChem CID89116873
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name(E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine
SMILESC/C(N)=C(/C)C(C)C(C)C(C)C(C)C(C)C
InChIInChI=1S/C15H31N/c1-9(2)10(3)11(4)12(5)13(6)14(7)15(8)16/h9-13H,16H2,1-8H3/b15-14+
InChIKeyLKAPRAWPUSWNCX-CCEZHUSRSA-N
XLogP4.44
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine?
The IUPAC name of (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine (CID 89116873) is (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine.
What is the SMILES notation for (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine?
The canonical SMILES for (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine is C/C(N)=C(/C)C(C)C(C)C(C)C(C)C(C)C.
What is the InChIKey of (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine?
The InChIKey is LKAPRAWPUSWNCX-CCEZHUSRSA-N. The full InChI is InChI=1S/C15H31N/c1-9(2)10(3)11(4)12(5)13(6)14(7)15(8)16/h9-13H,16H2,1-8H3/b15-14+.
What are the key properties of (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine?
(E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine has a molecular weight of 225.42 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3,4,5,6,7,8-hexamethylnon-2-en-2-amine is sourced from PubChem (CID 89116873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).