1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol

C9H21NO3 — CID 114493478

IUPAC1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol
SMILESCOCCONCC(C)(O)C(C)C
InChIInChI=1S/C9H21NO3/c1-8(2)9(3,11)7-10-13-6-5-12-4/h8,10-11H,5-7H2,1-4H3
InChIKeyNBMAAXIJGPDTAM-UHFFFAOYSA-N
MW191.27 g/mol
LogP0.56
Rot. Bonds7

About 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol

1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol (PubChem CID 114493478) has the molecular formula C9H21NO3 and a molecular weight of 191.27 g/mol. Its IUPAC name is 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol.

Molecular Properties

Compound Name1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol
PubChem CID114493478
Molecular FormulaC9H21NO3
Molecular Weight191.27 g/mol
Exact Mass191.15
IUPAC Name1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol
SMILESCOCCONCC(C)(O)C(C)C
InChIInChI=1S/C9H21NO3/c1-8(2)9(3,11)7-10-13-6-5-12-4/h8,10-11H,5-7H2,1-4H3
InChIKeyNBMAAXIJGPDTAM-UHFFFAOYSA-N
XLogP0.56
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,3-dimethyl-1-(2,2,2-trifluoroethoxyamino)butan-2-ol
CID 114493475
2-[(2-methoxyethoxyamino)methyl]-2-methylbutan-1-ol
CID 82711613
N-(2-methoxyethoxy)-3-methylbutan-1-amine
CID 82711034
methyl 2-[(2-hydroxy-2,3-dimethylbutyl)amino]-3-methylbutanoate
CID 114492798
1-[2-(2-methoxyethyl)anilino]-2,3-dimethylbutan-2-ol
CID 102905135
N-(2-hydroxy-2,3-dimethylbutyl)-3-(2-methylpropoxy)propanamide
CID 111484023
1-(2-methoxyethoxyamino)-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106990341
2-methoxy-N-(2-methoxyethoxy)ethanamine
CID 82723121
1-(3-butoxypropylamino)-2,3-dimethylbutan-2-ol
CID 114447493
1-(tert-butylamino)-5-methoxy-2,3-dimethylpentan-2-ol
CID 116500217
2-[(2-hydroxy-2,3-dimethylbutyl)amino]acetic acid
CID 114494765
dimethyl 2-(2-hydroxy-2,3-dimethylbutyl)propanedioate
CID 114497667

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol?
The IUPAC name of 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol (CID 114493478) is 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol.
What is the SMILES notation for 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol?
The canonical SMILES for 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol is COCCONCC(C)(O)C(C)C.
What is the InChIKey of 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol?
The InChIKey is NBMAAXIJGPDTAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO3/c1-8(2)9(3,11)7-10-13-6-5-12-4/h8,10-11H,5-7H2,1-4H3.
What are the key properties of 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol?
1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol has a molecular weight of 191.27 g/mol, XLogP of 0.56, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxyamino)-2,3-dimethylbutan-2-ol is sourced from PubChem (CID 114493478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).