(3Z)-5-butyldeca-1,3-dien-4-amine

C14H27N — CID 88814381

IUPAC(3Z)-5-butyldeca-1,3-dien-4-amine
SMILESC=C/C=C(\N)C(CCCC)CCCCC
InChIInChI=1S/C14H27N/c1-4-7-9-12-13(11-8-5-2)14(15)10-6-3/h6,10,13H,3-5,7-9,11-12,15H2,1-2H3/b14-10-
InChIKeyRESYCOXMNFZNDN-UVTDQMKNSA-N
MW209.38 g/mol
LogP4.40
Rot. Bonds9

About (3Z)-5-butyldeca-1,3-dien-4-amine

(3Z)-5-butyldeca-1,3-dien-4-amine (PubChem CID 88814381) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is (3Z)-5-butyldeca-1,3-dien-4-amine.

Molecular Properties

Compound Name(3Z)-5-butyldeca-1,3-dien-4-amine
PubChem CID88814381
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name(3Z)-5-butyldeca-1,3-dien-4-amine
SMILESC=C/C=C(\N)C(CCCC)CCCCC
InChIInChI=1S/C14H27N/c1-4-7-9-12-13(11-8-5-2)14(15)10-6-3/h6,10,13H,3-5,7-9,11-12,15H2,1-2H3/b14-10-
InChIKeyRESYCOXMNFZNDN-UVTDQMKNSA-N
XLogP4.40
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 ≤ 54.40
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 (3Z)-5-butyldeca-1,3-dien-4-amine?
The IUPAC name of (3Z)-5-butyldeca-1,3-dien-4-amine (CID 88814381) is (3Z)-5-butyldeca-1,3-dien-4-amine.
What is the SMILES notation for (3Z)-5-butyldeca-1,3-dien-4-amine?
The canonical SMILES for (3Z)-5-butyldeca-1,3-dien-4-amine is C=C/C=C(\N)C(CCCC)CCCCC.
What is the InChIKey of (3Z)-5-butyldeca-1,3-dien-4-amine?
The InChIKey is RESYCOXMNFZNDN-UVTDQMKNSA-N. The full InChI is InChI=1S/C14H27N/c1-4-7-9-12-13(11-8-5-2)14(15)10-6-3/h6,10,13H,3-5,7-9,11-12,15H2,1-2H3/b14-10-.
What are the key properties of (3Z)-5-butyldeca-1,3-dien-4-amine?
(3Z)-5-butyldeca-1,3-dien-4-amine has a molecular weight of 209.38 g/mol, XLogP of 4.40, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-5-butyldeca-1,3-dien-4-amine is sourced from PubChem (CID 88814381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).