(Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide

C14H24N2O — CID 89214769

IUPAC(Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide
SMILESC=C(N)CC(/C=C\C)C(=O)NC1CCCCC1
InChIInChI=1S/C14H24N2O/c1-3-7-12(10-11(2)15)14(17)16-13-8-5-4-6-9-13/h3,7,12-13H,2,4-6,8-10,15H2,1H3,(H,16,17)/b7-3-
InChIKeyPAXUMYWEIPJEMG-CLTKARDFSA-N
MW236.36 g/mol
LogP2.49
Rot. Bonds5

About (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide

(Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide (PubChem CID 89214769) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide.

Molecular Properties

Compound Name(Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide
PubChem CID89214769
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name(Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide
SMILESC=C(N)CC(/C=C\C)C(=O)NC1CCCCC1
InChIInChI=1S/C14H24N2O/c1-3-7-12(10-11(2)15)14(17)16-13-8-5-4-6-9-13/h3,7,12-13H,2,4-6,8-10,15H2,1H3,(H,16,17)/b7-3-
InChIKeyPAXUMYWEIPJEMG-CLTKARDFSA-N
XLogP2.49
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.49
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 (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide?
The IUPAC name of (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide (CID 89214769) is (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide.
What is the SMILES notation for (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide?
The canonical SMILES for (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide is C=C(N)CC(/C=C\C)C(=O)NC1CCCCC1.
What is the InChIKey of (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide?
The InChIKey is PAXUMYWEIPJEMG-CLTKARDFSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-7-12(10-11(2)15)14(17)16-13-8-5-4-6-9-13/h3,7,12-13H,2,4-6,8-10,15H2,1H3,(H,16,17)/b7-3-.
What are the key properties of (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide?
(Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide has a molecular weight of 236.36 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(2-aminoprop-2-enyl)-N-cyclohexylpent-3-enamide is sourced from PubChem (CID 89214769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).