2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide

C12H25NO3 — CID 134170006

IUPAC2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
SMILESCC(C)(C)OCCNC(=O)COC(C)(C)C
InChIInChI=1S/C12H25NO3/c1-11(2,3)15-8-7-13-10(14)9-16-12(4,5)6/h7-9H2,1-6H3,(H,13,14)
InChIKeyRQZBTGWPMGQROV-UHFFFAOYSA-N
MW231.34 g/mol
LogP1.73
Rot. Bonds5

About 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide

2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide (PubChem CID 134170006) has the molecular formula C12H25NO3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
PubChem CID134170006
Molecular FormulaC12H25NO3
Molecular Weight231.34 g/mol
Exact Mass231.18
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
SMILESCC(C)(C)OCCNC(=O)COC(C)(C)C
InChIInChI=1S/C12H25NO3/c1-11(2,3)15-8-7-13-10(14)9-16-12(4,5)6/h7-9H2,1-6H3,(H,13,14)
InChIKeyRQZBTGWPMGQROV-UHFFFAOYSA-N
XLogP1.73
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-methoxybutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605413
3,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]butanamide
CID 155613017
N-(4-hydroxybutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 106843199
2-[(2-methylpropan-2-yl)oxy]-N-(3-sulfanylpropyl)acetamide
CID 155051712
N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide
CID 54494115
2-[(2-methylpropan-2-yl)oxy]-N-(2-methylsulfonylethyl)acetamide
CID 112605102
N-hexyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605068
bis(1,6-bis[(2-methylpropan-2-yl)oxy]hexan-3-one);bis(1,5-bis[(2-methylpropan-2-yl)oxy]pentan-2-one);2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propane;bis(2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide);bis(3-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propanamide)
CID 164974010
4-methyl-4-(methylamino)-N-[2-[2-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]ethoxy]ethyl]pentanamide
CID 171442691
N-(6-bromohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 107847524
N-[2-(4-aminophenoxy)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112601847
N-(4-hydroxypentyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 107300430

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide (CID 134170006) is 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide is CC(C)(C)OCCNC(=O)COC(C)(C)C.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide?
The InChIKey is RQZBTGWPMGQROV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO3/c1-11(2,3)15-8-7-13-10(14)9-16-12(4,5)6/h7-9H2,1-6H3,(H,13,14).
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide?
2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide has a molecular weight of 231.34 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]acetamide is sourced from PubChem (CID 134170006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).