N-(2-but-3-enoxyethyl)butanamide

C10H19NO2 — CID 103855703

IUPACN-(2-but-3-enoxyethyl)butanamide
SMILESC=CCCOCCNC(=O)CCC
InChIInChI=1S/C10H19NO2/c1-3-5-8-13-9-7-11-10(12)6-4-2/h3H,1,4-9H2,2H3,(H,11,12)
InChIKeyMJHNDERHIPSGEY-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.50
Rot. Bonds8

About N-(2-but-3-enoxyethyl)butanamide

N-(2-but-3-enoxyethyl)butanamide (PubChem CID 103855703) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-(2-but-3-enoxyethyl)butanamide.

Molecular Properties

Compound NameN-(2-but-3-enoxyethyl)butanamide
PubChem CID103855703
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-(2-but-3-enoxyethyl)butanamide
SMILESC=CCCOCCNC(=O)CCC
InChIInChI=1S/C10H19NO2/c1-3-5-8-13-9-7-11-10(12)6-4-2/h3H,1,4-9H2,2H3,(H,11,12)
InChIKeyMJHNDERHIPSGEY-UHFFFAOYSA-N
XLogP1.50
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.50
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 N-(2-but-3-enoxyethyl)butanamide?
The IUPAC name of N-(2-but-3-enoxyethyl)butanamide (CID 103855703) is N-(2-but-3-enoxyethyl)butanamide.
What is the SMILES notation for N-(2-but-3-enoxyethyl)butanamide?
The canonical SMILES for N-(2-but-3-enoxyethyl)butanamide is C=CCCOCCNC(=O)CCC.
What is the InChIKey of N-(2-but-3-enoxyethyl)butanamide?
The InChIKey is MJHNDERHIPSGEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-5-8-13-9-7-11-10(12)6-4-2/h3H,1,4-9H2,2H3,(H,11,12).
What are the key properties of N-(2-but-3-enoxyethyl)butanamide?
N-(2-but-3-enoxyethyl)butanamide has a molecular weight of 185.27 g/mol, XLogP of 1.50, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-but-3-enoxyethyl)butanamide is sourced from PubChem (CID 103855703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).