(E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine

C10H20N2 — CID 156797047

IUPAC(E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine
SMILESC/C=N/C=C(\C)C(C)CCNC
InChIInChI=1S/C10H20N2/c1-5-12-8-10(3)9(2)6-7-11-4/h5,8-9,11H,6-7H2,1-4H3/b10-8+,12-5+
InChIKeyGCFJXQGDTDREAA-ZROACKIGSA-N
MW168.28 g/mol
LogP2.23
Rot. Bonds5

About (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine

(E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine (PubChem CID 156797047) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine.

Molecular Properties

Compound Name(E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine
PubChem CID156797047
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine
SMILESC/C=N/C=C(\C)C(C)CCNC
InChIInChI=1S/C10H20N2/c1-5-12-8-10(3)9(2)6-7-11-4/h5,8-9,11H,6-7H2,1-4H3/b10-8+,12-5+
InChIKeyGCFJXQGDTDREAA-ZROACKIGSA-N
XLogP2.23
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.23
H-Bond Donors ≤ 51
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)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine?
The IUPAC name of (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine (CID 156797047) is (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine.
What is the SMILES notation for (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine?
The canonical SMILES for (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine is C/C=N/C=C(\C)C(C)CCNC.
What is the InChIKey of (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine?
The InChIKey is GCFJXQGDTDREAA-ZROACKIGSA-N. The full InChI is InChI=1S/C10H20N2/c1-5-12-8-10(3)9(2)6-7-11-4/h5,8-9,11H,6-7H2,1-4H3/b10-8+,12-5+.
What are the key properties of (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine?
(E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine has a molecular weight of 168.28 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-(ethylideneamino)-N,3,4-trimethylpent-4-en-1-amine is sourced from PubChem (CID 156797047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).