N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide

C11H22N2O — CID 129024448

IUPACN-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide
SMILESC=C(C(C)C)N(C)CCN(C)C(C)=O
InChIInChI=1S/C11H22N2O/c1-9(2)10(3)12(5)7-8-13(6)11(4)14/h9H,3,7-8H2,1-2,4-6H3
InChIKeyKNUCGSHAKCLTGC-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.57
Rot. Bonds5

About N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide

N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide (PubChem CID 129024448) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide
PubChem CID129024448
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide
SMILESC=C(C(C)C)N(C)CCN(C)C(C)=O
InChIInChI=1S/C11H22N2O/c1-9(2)10(3)12(5)7-8-13(6)11(4)14/h9H,3,7-8H2,1-2,4-6H3
InChIKeyKNUCGSHAKCLTGC-UHFFFAOYSA-N
XLogP1.57
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide?
The IUPAC name of N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide (CID 129024448) is N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide.
What is the SMILES notation for N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide?
The canonical SMILES for N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide is C=C(C(C)C)N(C)CCN(C)C(C)=O.
What is the InChIKey of N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide?
The InChIKey is KNUCGSHAKCLTGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(2)10(3)12(5)7-8-13(6)11(4)14/h9H,3,7-8H2,1-2,4-6H3.
What are the key properties of N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide?
N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide has a molecular weight of 198.31 g/mol, XLogP of 1.57, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[methyl(3-methylbut-1-en-2-yl)amino]ethyl]acetamide is sourced from PubChem (CID 129024448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).