(2R,3E,5E)-tetradeca-3,5-dien-2-amine

C14H27N — CID 10443078

IUPAC(2R,3E,5E)-tetradeca-3,5-dien-2-amine
SMILESCCCCCCCC/C=C/C=C/[C@@H](C)N
InChIInChI=1S/C14H27N/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h10-14H,3-9,15H2,1-2H3/b11-10+,13-12+/t14-/m1/s1
InChIKeyWCUPLXASCCDKJN-PBKZMAJUSA-N
MW209.38 g/mol
LogP4.20
Rot. Bonds9

About (2R,3E,5E)-tetradeca-3,5-dien-2-amine

(2R,3E,5E)-tetradeca-3,5-dien-2-amine (PubChem CID 10443078) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is (2R,3E,5E)-tetradeca-3,5-dien-2-amine.

Molecular Properties

Compound Name(2R,3E,5E)-tetradeca-3,5-dien-2-amine
PubChem CID10443078
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name(2R,3E,5E)-tetradeca-3,5-dien-2-amine
SMILESCCCCCCCC/C=C/C=C/[C@@H](C)N
InChIInChI=1S/C14H27N/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h10-14H,3-9,15H2,1-2H3/b11-10+,13-12+/t14-/m1/s1
InChIKeyWCUPLXASCCDKJN-PBKZMAJUSA-N
XLogP4.20
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R,3E,5E)-tetradeca-3,5-dien-2-amine?
The IUPAC name of (2R,3E,5E)-tetradeca-3,5-dien-2-amine (CID 10443078) is (2R,3E,5E)-tetradeca-3,5-dien-2-amine.
What is the SMILES notation for (2R,3E,5E)-tetradeca-3,5-dien-2-amine?
The canonical SMILES for (2R,3E,5E)-tetradeca-3,5-dien-2-amine is CCCCCCCC/C=C/C=C/[C@@H](C)N.
What is the InChIKey of (2R,3E,5E)-tetradeca-3,5-dien-2-amine?
The InChIKey is WCUPLXASCCDKJN-PBKZMAJUSA-N. The full InChI is InChI=1S/C14H27N/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h10-14H,3-9,15H2,1-2H3/b11-10+,13-12+/t14-/m1/s1.
What are the key properties of (2R,3E,5E)-tetradeca-3,5-dien-2-amine?
(2R,3E,5E)-tetradeca-3,5-dien-2-amine has a molecular weight of 209.38 g/mol, XLogP of 4.20, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3E,5E)-tetradeca-3,5-dien-2-amine is sourced from PubChem (CID 10443078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).