(E)-N,N-dimethyltridec-1-en-1-amine

C15H31N — CID 22930917

IUPAC(E)-N,N-dimethyltridec-1-en-1-amine
SMILESCCCCCCCCCCC/C=C/N(C)C
InChIInChI=1S/C15H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16(2)3/h14-15H,4-13H2,1-3H3/b15-14+
InChIKeyFATHUUFOBYMGTR-CCEZHUSRSA-N
MW225.42 g/mol
LogP4.98
Rot. Bonds11

About (E)-N,N-dimethyltridec-1-en-1-amine

(E)-N,N-dimethyltridec-1-en-1-amine (PubChem CID 22930917) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is (E)-N,N-dimethyltridec-1-en-1-amine.

Molecular Properties

Compound Name(E)-N,N-dimethyltridec-1-en-1-amine
PubChem CID22930917
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name(E)-N,N-dimethyltridec-1-en-1-amine
SMILESCCCCCCCCCCC/C=C/N(C)C
InChIInChI=1S/C15H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16(2)3/h14-15H,4-13H2,1-3H3/b15-14+
InChIKeyFATHUUFOBYMGTR-CCEZHUSRSA-N
XLogP4.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-N,N-dimethyltridec-1-en-1-amine?
The IUPAC name of (E)-N,N-dimethyltridec-1-en-1-amine (CID 22930917) is (E)-N,N-dimethyltridec-1-en-1-amine.
What is the SMILES notation for (E)-N,N-dimethyltridec-1-en-1-amine?
The canonical SMILES for (E)-N,N-dimethyltridec-1-en-1-amine is CCCCCCCCCCC/C=C/N(C)C.
What is the InChIKey of (E)-N,N-dimethyltridec-1-en-1-amine?
The InChIKey is FATHUUFOBYMGTR-CCEZHUSRSA-N. The full InChI is InChI=1S/C15H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16(2)3/h14-15H,4-13H2,1-3H3/b15-14+.
What are the key properties of (E)-N,N-dimethyltridec-1-en-1-amine?
(E)-N,N-dimethyltridec-1-en-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.98, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-dimethyltridec-1-en-1-amine is sourced from PubChem (CID 22930917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).