(E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine

C19H36N2 — CID 139397148

IUPAC(E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine
SMILESC=C/N=C(CCC(C)CCC)/C(CC)=C(\C)N(C)CCC
InChIInChI=1S/C19H36N2/c1-8-12-16(5)13-14-19(20-11-4)18(10-3)17(6)21(7)15-9-2/h11,16H,4,8-10,12-15H2,1-3,5-7H3/b18-17+,20-19+
InChIKeyDGZMFIFSSPIHRD-GHPQSQKNSA-N
MW292.51 g/mol
LogP5.81
Rot. Bonds11

About (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine

(E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine (PubChem CID 139397148) has the molecular formula C19H36N2 and a molecular weight of 292.51 g/mol. Its IUPAC name is (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine.

Molecular Properties

Compound Name(E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine
PubChem CID139397148
Molecular FormulaC19H36N2
Molecular Weight292.51 g/mol
Exact Mass292.29
IUPAC Name(E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine
SMILESC=C/N=C(CCC(C)CCC)/C(CC)=C(\C)N(C)CCC
InChIInChI=1S/C19H36N2/c1-8-12-16(5)13-14-19(20-11-4)18(10-3)17(6)21(7)15-9-2/h11,16H,4,8-10,12-15H2,1-3,5-7H3/b18-17+,20-19+
InChIKeyDGZMFIFSSPIHRD-GHPQSQKNSA-N
XLogP5.81
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.51
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine?
The IUPAC name of (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine (CID 139397148) is (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine.
What is the SMILES notation for (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine?
The canonical SMILES for (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine is C=C/N=C(CCC(C)CCC)/C(CC)=C(\C)N(C)CCC.
What is the InChIKey of (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine?
The InChIKey is DGZMFIFSSPIHRD-GHPQSQKNSA-N. The full InChI is InChI=1S/C19H36N2/c1-8-12-16(5)13-14-19(20-11-4)18(10-3)17(6)21(7)15-9-2/h11,16H,4,8-10,12-15H2,1-3,5-7H3/b18-17+,20-19+.
What are the key properties of (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine?
(E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine has a molecular weight of 292.51 g/mol, XLogP of 5.81, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-ethenylimino-3-ethyl-N,7-dimethyl-N-propyldec-2-en-2-amine is sourced from PubChem (CID 139397148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).