2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol

C9H21NO3 — CID 115643011

IUPAC2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol
SMILESCOCC(C)(C)NCCOCCO
InChIInChI=1S/C9H21NO3/c1-9(2,8-12-3)10-4-6-13-7-5-11/h10-11H,4-8H2,1-3H3
InChIKeyWOLFINUGFVZAEH-UHFFFAOYSA-N
MW191.27 g/mol
LogP0.01
Rot. Bonds8

About 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol

2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol (PubChem CID 115643011) has the molecular formula C9H21NO3 and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol
PubChem CID115643011
Molecular FormulaC9H21NO3
Molecular Weight191.27 g/mol
Exact Mass191.15
IUPAC Name2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol
SMILESCOCC(C)(C)NCCOCCO
InChIInChI=1S/C9H21NO3/c1-9(2,8-12-3)10-4-6-13-7-5-11/h10-11H,4-8H2,1-3H3
InChIKeyWOLFINUGFVZAEH-UHFFFAOYSA-N
XLogP0.01
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-N-[2-(3-methoxypropoxy)ethyl]-2-methylpropan-2-amine
CID 103179461
1-methoxy-N-(2-methoxyethyl)-2-methylpropan-2-amine
CID 115609446
1-methoxy-2-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propan-2-amine
CID 115609397
2-[2-[2-[2-(2-methylpentadecan-2-ylamino)ethoxy]ethoxy]ethoxy]ethanol
CID 138401408
4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol
CID 115679518
2-[2-(2-cyclopropylpropan-2-ylamino)ethoxy]ethanol
CID 104577928
2-[2-[4-(tert-butylamino)-2,2-difluorobutoxy]ethoxy]ethanol
CID 167253727
N-(1-methoxy-2-methylpropan-2-yl)hexan-1-amine
CID 115644983
2-[3-(tert-butylamino)propoxy]ethanol
CID 150900173
2-(ethylamino)-N-[2-(2-hydroxyethoxy)ethyl]-2-methylpropanamide
CID 62834232
2-[2-(2-methoxy-2-methylpropoxy)ethoxy]ethanol
CID 174420073
ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine
CID 177317291

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol?
The IUPAC name of 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol (CID 115643011) is 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol?
The canonical SMILES for 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol is COCC(C)(C)NCCOCCO.
What is the InChIKey of 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol?
The InChIKey is WOLFINUGFVZAEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO3/c1-9(2,8-12-3)10-4-6-13-7-5-11/h10-11H,4-8H2,1-3H3.
What are the key properties of 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol?
2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol has a molecular weight of 191.27 g/mol, XLogP of 0.01, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol is sourced from PubChem (CID 115643011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).