(E)-N-methoxy-N-methylhex-2-enamide

C8H15NO2 — CID 11073681

IUPAC(E)-N-methoxy-N-methylhex-2-enamide
SMILESCCC/C=C/C(=O)N(C)OC
InChIInChI=1S/C8H15NO2/c1-4-5-6-7-8(10)9(2)11-3/h6-7H,4-5H2,1-3H3/b7-6+
InChIKeyAFBHROHPBNKTEB-VOTSOKGWSA-N
MW157.21 g/mol
LogP1.36
Rot. Bonds4

About (E)-N-methoxy-N-methylhex-2-enamide

(E)-N-methoxy-N-methylhex-2-enamide (PubChem CID 11073681) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is (E)-N-methoxy-N-methylhex-2-enamide.

Molecular Properties

Compound Name(E)-N-methoxy-N-methylhex-2-enamide
PubChem CID11073681
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name(E)-N-methoxy-N-methylhex-2-enamide
SMILESCCC/C=C/C(=O)N(C)OC
InChIInChI=1S/C8H15NO2/c1-4-5-6-7-8(10)9(2)11-3/h6-7H,4-5H2,1-3H3/b7-6+
InChIKeyAFBHROHPBNKTEB-VOTSOKGWSA-N
XLogP1.36
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-N-methoxy-N-methylhex-2-enamide?
The IUPAC name of (E)-N-methoxy-N-methylhex-2-enamide (CID 11073681) is (E)-N-methoxy-N-methylhex-2-enamide.
What is the SMILES notation for (E)-N-methoxy-N-methylhex-2-enamide?
The canonical SMILES for (E)-N-methoxy-N-methylhex-2-enamide is CCC/C=C/C(=O)N(C)OC.
What is the InChIKey of (E)-N-methoxy-N-methylhex-2-enamide?
The InChIKey is AFBHROHPBNKTEB-VOTSOKGWSA-N. The full InChI is InChI=1S/C8H15NO2/c1-4-5-6-7-8(10)9(2)11-3/h6-7H,4-5H2,1-3H3/b7-6+.
What are the key properties of (E)-N-methoxy-N-methylhex-2-enamide?
(E)-N-methoxy-N-methylhex-2-enamide has a molecular weight of 157.21 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-methoxy-N-methylhex-2-enamide is sourced from PubChem (CID 11073681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).