[ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol

C8H17NO2 — CID 90291442

IUPAC[ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol
SMILESC=CN(C)C(O)OC(C)(C)C
InChIInChI=1S/C8H17NO2/c1-6-9(5)7(10)11-8(2,3)4/h6-7,10H,1H2,2-5H3
InChIKeyPPFVGPDOJVDQPB-UHFFFAOYSA-N
MW159.23 g/mol
LogP1.15
Rot. Bonds3

About [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol

[ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol (PubChem CID 90291442) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol.

Molecular Properties

Compound Name[ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol
PubChem CID90291442
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name[ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol
SMILESC=CN(C)C(O)OC(C)(C)C
InChIInChI=1S/C8H17NO2/c1-6-9(5)7(10)11-8(2,3)4/h6-7,10H,1H2,2-5H3
InChIKeyPPFVGPDOJVDQPB-UHFFFAOYSA-N
XLogP1.15
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

4-[(2-methylpropan-2-yl)oxy]hexa-1,5-dien-3-ol
CID 123974512
bis[(2-methylpropan-2-yl)oxy]methanol
CID 121276629
2-hydroxy-2-[(2-methylpropan-2-yl)oxy]acetaldehyde
CID 87848931
2-methyl-2-propan-2-yloxypropane;propan-2-ol
CID 88729747
ethane;N-ethenyl-N-methylpropan-2-amine
CID 145207975
N-(difluoromethyl)-N-methylethenamine
CID 162573446
2-(1-hydroxyprop-2-enoxy)propan-2-ol
CID 174666718
N-methyl-1-[(2-methylpropan-2-yl)oxy]but-3-en-2-amine
CID 105161117
methyl 2-[[hydroxy-[(2-methylpropan-2-yl)oxy]methyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]prop-2-enoate
CID 170419078
2,2,2-trichloro-1-[(2-methylpropan-2-yl)oxy]ethanol
CID 71350127
N,N-dimethyl-1-[(2-methylpropan-2-yl)oxy]ethenamine
CID 89011390
N-ethenyl-N,2-dimethylpropan-2-amine
CID 15241889

Frequently Asked Questions

What is the IUPAC name of [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol?
The IUPAC name of [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol (CID 90291442) is [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol.
What is the SMILES notation for [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol?
The canonical SMILES for [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol is C=CN(C)C(O)OC(C)(C)C.
What is the InChIKey of [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol?
The InChIKey is PPFVGPDOJVDQPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-6-9(5)7(10)11-8(2,3)4/h6-7,10H,1H2,2-5H3.
What are the key properties of [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol?
[ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol has a molecular weight of 159.23 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [ethenyl(methyl)amino]-[(2-methylpropan-2-yl)oxy]methanol is sourced from PubChem (CID 90291442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).