(4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine

C14H27N — CID 18398272

IUPAC(4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine
SMILESCCNC(C)C/C=C(/C)CCC=C(C)C
InChIInChI=1S/C14H27N/c1-6-15-14(5)11-10-13(4)9-7-8-12(2)3/h8,10,14-15H,6-7,9,11H2,1-5H3/b13-10-
InChIKeyNHCGNAOGORLZCJ-RAXLEYEMSA-N
MW209.38 g/mol
LogP4.07
Rot. Bonds7

About (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine

(4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine (PubChem CID 18398272) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine.

Molecular Properties

Compound Name(4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine
PubChem CID18398272
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name(4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine
SMILESCCNC(C)C/C=C(/C)CCC=C(C)C
InChIInChI=1S/C14H27N/c1-6-15-14(5)11-10-13(4)9-7-8-12(2)3/h8,10,14-15H,6-7,9,11H2,1-5H3/b13-10-
InChIKeyNHCGNAOGORLZCJ-RAXLEYEMSA-N
XLogP4.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine?
The IUPAC name of (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine (CID 18398272) is (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine.
What is the SMILES notation for (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine?
The canonical SMILES for (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine is CCNC(C)C/C=C(/C)CCC=C(C)C.
What is the InChIKey of (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine?
The InChIKey is NHCGNAOGORLZCJ-RAXLEYEMSA-N. The full InChI is InChI=1S/C14H27N/c1-6-15-14(5)11-10-13(4)9-7-8-12(2)3/h8,10,14-15H,6-7,9,11H2,1-5H3/b13-10-.
What are the key properties of (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine?
(4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine has a molecular weight of 209.38 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-N-ethyl-5,9-dimethyldeca-4,8-dien-2-amine is sourced from PubChem (CID 18398272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).