N-(2,3-dimethylpent-4-en-2-yl)acetamide

C9H17NO — CID 143357201

IUPACN-(2,3-dimethylpent-4-en-2-yl)acetamide
SMILESC=CC(C)C(C)(C)NC(C)=O
InChIInChI=1S/C9H17NO/c1-6-7(2)9(4,5)10-8(3)11/h6-7H,1H2,2-5H3,(H,10,11)
InChIKeyDNEFCNSVYDIITC-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.72
Rot. Bonds3

About N-(2,3-dimethylpent-4-en-2-yl)acetamide

N-(2,3-dimethylpent-4-en-2-yl)acetamide (PubChem CID 143357201) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-(2,3-dimethylpent-4-en-2-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylpent-4-en-2-yl)acetamide
PubChem CID143357201
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-(2,3-dimethylpent-4-en-2-yl)acetamide
SMILESC=CC(C)C(C)(C)NC(C)=O
InChIInChI=1S/C9H17NO/c1-6-7(2)9(4,5)10-8(3)11/h6-7H,1H2,2-5H3,(H,10,11)
InChIKeyDNEFCNSVYDIITC-UHFFFAOYSA-N
XLogP1.72
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.72
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 N-(2,3-dimethylpent-4-en-2-yl)acetamide?
The IUPAC name of N-(2,3-dimethylpent-4-en-2-yl)acetamide (CID 143357201) is N-(2,3-dimethylpent-4-en-2-yl)acetamide.
What is the SMILES notation for N-(2,3-dimethylpent-4-en-2-yl)acetamide?
The canonical SMILES for N-(2,3-dimethylpent-4-en-2-yl)acetamide is C=CC(C)C(C)(C)NC(C)=O.
What is the InChIKey of N-(2,3-dimethylpent-4-en-2-yl)acetamide?
The InChIKey is DNEFCNSVYDIITC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-6-7(2)9(4,5)10-8(3)11/h6-7H,1H2,2-5H3,(H,10,11).
What are the key properties of N-(2,3-dimethylpent-4-en-2-yl)acetamide?
N-(2,3-dimethylpent-4-en-2-yl)acetamide has a molecular weight of 155.24 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylpent-4-en-2-yl)acetamide is sourced from PubChem (CID 143357201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).