(Z)-N-butan-2-ylhex-3-enamide

C10H19NO — CID 88870257

IUPAC(Z)-N-butan-2-ylhex-3-enamide
SMILESCC/C=C\CC(=O)NC(C)CC
InChIInChI=1S/C10H19NO/c1-4-6-7-8-10(12)11-9(3)5-2/h6-7,9H,4-5,8H2,1-3H3,(H,11,12)/b7-6-
InChIKeyIYZIJPGVXDDXRA-SREVYHEPSA-N
MW169.27 g/mol
LogP2.26
Rot. Bonds5

About (Z)-N-butan-2-ylhex-3-enamide

(Z)-N-butan-2-ylhex-3-enamide (PubChem CID 88870257) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (Z)-N-butan-2-ylhex-3-enamide.

Molecular Properties

Compound Name(Z)-N-butan-2-ylhex-3-enamide
PubChem CID88870257
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(Z)-N-butan-2-ylhex-3-enamide
SMILESCC/C=C\CC(=O)NC(C)CC
InChIInChI=1S/C10H19NO/c1-4-6-7-8-10(12)11-9(3)5-2/h6-7,9H,4-5,8H2,1-3H3,(H,11,12)/b7-6-
InChIKeyIYZIJPGVXDDXRA-SREVYHEPSA-N
XLogP2.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.26
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 (Z)-N-butan-2-ylhex-3-enamide?
The IUPAC name of (Z)-N-butan-2-ylhex-3-enamide (CID 88870257) is (Z)-N-butan-2-ylhex-3-enamide.
What is the SMILES notation for (Z)-N-butan-2-ylhex-3-enamide?
The canonical SMILES for (Z)-N-butan-2-ylhex-3-enamide is CC/C=C\CC(=O)NC(C)CC.
What is the InChIKey of (Z)-N-butan-2-ylhex-3-enamide?
The InChIKey is IYZIJPGVXDDXRA-SREVYHEPSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-6-7-8-10(12)11-9(3)5-2/h6-7,9H,4-5,8H2,1-3H3,(H,11,12)/b7-6-.
What are the key properties of (Z)-N-butan-2-ylhex-3-enamide?
(Z)-N-butan-2-ylhex-3-enamide has a molecular weight of 169.27 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-butan-2-ylhex-3-enamide is sourced from PubChem (CID 88870257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).