N-methyl-N-(3-methylbut-2-en-2-yl)acetamide

C8H15NO — CID 20651561

IUPACN-methyl-N-(3-methylbut-2-en-2-yl)acetamide
SMILESCC(=O)N(C)C(C)=C(C)C
InChIInChI=1S/C8H15NO/c1-6(2)7(3)9(5)8(4)10/h1-5H3
InChIKeyOZAYYEMBFVYUEN-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.78
Rot. Bonds1

About N-methyl-N-(3-methylbut-2-en-2-yl)acetamide

N-methyl-N-(3-methylbut-2-en-2-yl)acetamide (PubChem CID 20651561) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-methyl-N-(3-methylbut-2-en-2-yl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(3-methylbut-2-en-2-yl)acetamide
PubChem CID20651561
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-methyl-N-(3-methylbut-2-en-2-yl)acetamide
SMILESCC(=O)N(C)C(C)=C(C)C
InChIInChI=1S/C8H15NO/c1-6(2)7(3)9(5)8(4)10/h1-5H3
InChIKeyOZAYYEMBFVYUEN-UHFFFAOYSA-N
XLogP1.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylbut-2-en-2-yl)acetamide?
The IUPAC name of N-methyl-N-(3-methylbut-2-en-2-yl)acetamide (CID 20651561) is N-methyl-N-(3-methylbut-2-en-2-yl)acetamide.
What is the SMILES notation for N-methyl-N-(3-methylbut-2-en-2-yl)acetamide?
The canonical SMILES for N-methyl-N-(3-methylbut-2-en-2-yl)acetamide is CC(=O)N(C)C(C)=C(C)C.
What is the InChIKey of N-methyl-N-(3-methylbut-2-en-2-yl)acetamide?
The InChIKey is OZAYYEMBFVYUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6(2)7(3)9(5)8(4)10/h1-5H3.
What are the key properties of N-methyl-N-(3-methylbut-2-en-2-yl)acetamide?
N-methyl-N-(3-methylbut-2-en-2-yl)acetamide has a molecular weight of 141.21 g/mol, XLogP of 1.78, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylbut-2-en-2-yl)acetamide is sourced from PubChem (CID 20651561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).