2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide

C12H24N2O — CID 130272220

IUPAC2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide
SMILESCCC(C)(C)N1CC(NC(=O)C(C)C)C1
InChIInChI=1S/C12H24N2O/c1-6-12(4,5)14-7-10(8-14)13-11(15)9(2)3/h9-10H,6-8H2,1-5H3,(H,13,15)
InChIKeyYPYHNEZWOCUXHO-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.63
Rot. Bonds4

About 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide

2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide (PubChem CID 130272220) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide
PubChem CID130272220
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide
SMILESCCC(C)(C)N1CC(NC(=O)C(C)C)C1
InChIInChI=1S/C12H24N2O/c1-6-12(4,5)14-7-10(8-14)13-11(15)9(2)3/h9-10H,6-8H2,1-5H3,(H,13,15)
InChIKeyYPYHNEZWOCUXHO-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide?
The IUPAC name of 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide (CID 130272220) is 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide.
What is the SMILES notation for 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide?
The canonical SMILES for 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide is CCC(C)(C)N1CC(NC(=O)C(C)C)C1.
What is the InChIKey of 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide?
The InChIKey is YPYHNEZWOCUXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-6-12(4,5)14-7-10(8-14)13-11(15)9(2)3/h9-10H,6-8H2,1-5H3,(H,13,15).
What are the key properties of 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide?
2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide has a molecular weight of 212.34 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(2-methylbutan-2-yl)azetidin-3-yl]propanamide is sourced from PubChem (CID 130272220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).