(E)-2-ethyl-N-methylhex-2-en-1-amine

C9H19N — CID 55299102

IUPAC(E)-2-ethyl-N-methylhex-2-en-1-amine
SMILESCCC/C=C(\CC)CNC
InChIInChI=1S/C9H19N/c1-4-6-7-9(5-2)8-10-3/h7,10H,4-6,8H2,1-3H3/b9-7+
InChIKeySVHVKLUEODHTTC-VQHVLOKHSA-N
MW141.26 g/mol
LogP2.34
Rot. Bonds5

About (E)-2-ethyl-N-methylhex-2-en-1-amine

(E)-2-ethyl-N-methylhex-2-en-1-amine (PubChem CID 55299102) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is (E)-2-ethyl-N-methylhex-2-en-1-amine.

Molecular Properties

Compound Name(E)-2-ethyl-N-methylhex-2-en-1-amine
PubChem CID55299102
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name(E)-2-ethyl-N-methylhex-2-en-1-amine
SMILESCCC/C=C(\CC)CNC
InChIInChI=1S/C9H19N/c1-4-6-7-9(5-2)8-10-3/h7,10H,4-6,8H2,1-3H3/b9-7+
InChIKeySVHVKLUEODHTTC-VQHVLOKHSA-N
XLogP2.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.34
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 (E)-2-ethyl-N-methylhex-2-en-1-amine?
The IUPAC name of (E)-2-ethyl-N-methylhex-2-en-1-amine (CID 55299102) is (E)-2-ethyl-N-methylhex-2-en-1-amine.
What is the SMILES notation for (E)-2-ethyl-N-methylhex-2-en-1-amine?
The canonical SMILES for (E)-2-ethyl-N-methylhex-2-en-1-amine is CCC/C=C(\CC)CNC.
What is the InChIKey of (E)-2-ethyl-N-methylhex-2-en-1-amine?
The InChIKey is SVHVKLUEODHTTC-VQHVLOKHSA-N. The full InChI is InChI=1S/C9H19N/c1-4-6-7-9(5-2)8-10-3/h7,10H,4-6,8H2,1-3H3/b9-7+.
What are the key properties of (E)-2-ethyl-N-methylhex-2-en-1-amine?
(E)-2-ethyl-N-methylhex-2-en-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-ethyl-N-methylhex-2-en-1-amine is sourced from PubChem (CID 55299102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).