N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

C12H25NO2 — CID 87676537

IUPACN-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)CCN(C)C(=O)COC(C)(C)C
InChIInChI=1S/C12H25NO2/c1-10(2)7-8-13(6)11(14)9-15-12(3,4)5/h10H,7-9H2,1-6H3
InChIKeyFRDCEQWPRSLWMF-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.31
Rot. Bonds5

About N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 87676537) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID87676537
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC NameN-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)CCN(C)C(=O)COC(C)(C)C
InChIInChI=1S/C12H25NO2/c1-10(2)7-8-13(6)11(14)9-15-12(3,4)5/h10H,7-9H2,1-6H3
InChIKeyFRDCEQWPRSLWMF-UHFFFAOYSA-N
XLogP2.31
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 87676537) is N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide is CC(C)CCN(C)C(=O)COC(C)(C)C.
What is the InChIKey of N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is FRDCEQWPRSLWMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-10(2)7-8-13(6)11(14)9-15-12(3,4)5/h10H,7-9H2,1-6H3.
What are the key properties of N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 215.34 g/mol, XLogP of 2.31, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methylbutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 87676537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).