(Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide

C10H19NO2 — CID 143446318

IUPAC(Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide
SMILESC/C=C\C(C)C(=O)NCCOCC
InChIInChI=1S/C10H19NO2/c1-4-6-9(3)10(12)11-7-8-13-5-2/h4,6,9H,5,7-8H2,1-3H3,(H,11,12)/b6-4-
InChIKeyPCWSARCINRPGSB-XQRVVYSFSA-N
MW185.27 g/mol
LogP1.35
Rot. Bonds6

About (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide

(Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide (PubChem CID 143446318) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide.

Molecular Properties

Compound Name(Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide
PubChem CID143446318
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name(Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide
SMILESC/C=C\C(C)C(=O)NCCOCC
InChIInChI=1S/C10H19NO2/c1-4-6-9(3)10(12)11-7-8-13-5-2/h4,6,9H,5,7-8H2,1-3H3,(H,11,12)/b6-4-
InChIKeyPCWSARCINRPGSB-XQRVVYSFSA-N
XLogP1.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide?
The IUPAC name of (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide (CID 143446318) is (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide.
What is the SMILES notation for (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide?
The canonical SMILES for (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide is C/C=C\C(C)C(=O)NCCOCC.
What is the InChIKey of (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide?
The InChIKey is PCWSARCINRPGSB-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H19NO2/c1-4-6-9(3)10(12)11-7-8-13-5-2/h4,6,9H,5,7-8H2,1-3H3,(H,11,12)/b6-4-.
What are the key properties of (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide?
(Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide has a molecular weight of 185.27 g/mol, XLogP of 1.35, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(2-ethoxyethyl)-2-methylpent-3-enamide is sourced from PubChem (CID 143446318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).