(E)-N-cyclohexyl-2-hydroxypent-3-enamide

C11H19NO2 — CID 130015263

IUPAC(E)-N-cyclohexyl-2-hydroxypent-3-enamide
SMILESC/C=C/C(O)C(=O)NC1CCCCC1
InChIInChI=1S/C11H19NO2/c1-2-6-10(13)11(14)12-9-7-4-3-5-8-9/h2,6,9-10,13H,3-5,7-8H2,1H3,(H,12,14)/b6-2+
InChIKeyXOONNNGOPGLTPU-QHHAFSJGSA-N
MW197.28 g/mol
LogP1.37
Rot. Bonds3

About (E)-N-cyclohexyl-2-hydroxypent-3-enamide

(E)-N-cyclohexyl-2-hydroxypent-3-enamide (PubChem CID 130015263) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is (E)-N-cyclohexyl-2-hydroxypent-3-enamide.

Molecular Properties

Compound Name(E)-N-cyclohexyl-2-hydroxypent-3-enamide
PubChem CID130015263
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name(E)-N-cyclohexyl-2-hydroxypent-3-enamide
SMILESC/C=C/C(O)C(=O)NC1CCCCC1
InChIInChI=1S/C11H19NO2/c1-2-6-10(13)11(14)12-9-7-4-3-5-8-9/h2,6,9-10,13H,3-5,7-8H2,1H3,(H,12,14)/b6-2+
InChIKeyXOONNNGOPGLTPU-QHHAFSJGSA-N
XLogP1.37
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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)-N-cyclohexyl-2-hydroxypent-3-enamide?
The IUPAC name of (E)-N-cyclohexyl-2-hydroxypent-3-enamide (CID 130015263) is (E)-N-cyclohexyl-2-hydroxypent-3-enamide.
What is the SMILES notation for (E)-N-cyclohexyl-2-hydroxypent-3-enamide?
The canonical SMILES for (E)-N-cyclohexyl-2-hydroxypent-3-enamide is C/C=C/C(O)C(=O)NC1CCCCC1.
What is the InChIKey of (E)-N-cyclohexyl-2-hydroxypent-3-enamide?
The InChIKey is XOONNNGOPGLTPU-QHHAFSJGSA-N. The full InChI is InChI=1S/C11H19NO2/c1-2-6-10(13)11(14)12-9-7-4-3-5-8-9/h2,6,9-10,13H,3-5,7-8H2,1H3,(H,12,14)/b6-2+.
What are the key properties of (E)-N-cyclohexyl-2-hydroxypent-3-enamide?
(E)-N-cyclohexyl-2-hydroxypent-3-enamide has a molecular weight of 197.28 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-cyclohexyl-2-hydroxypent-3-enamide is sourced from PubChem (CID 130015263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).