2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol

C11H23NO2 — CID 115919249

IUPAC2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol
SMILESCC(NC(C)C(C)(C)O)C1CCOC1
InChIInChI=1S/C11H23NO2/c1-8(10-5-6-14-7-10)12-9(2)11(3,4)13/h8-10,12-13H,5-7H2,1-4H3
InChIKeyYUHOLEQMHFEKMO-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.16
Rot. Bonds4

About 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol

2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol (PubChem CID 115919249) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol.

Molecular Properties

Compound Name2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol
PubChem CID115919249
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol
SMILESCC(NC(C)C(C)(C)O)C1CCOC1
InChIInChI=1S/C11H23NO2/c1-8(10-5-6-14-7-10)12-9(2)11(3,4)13/h8-10,12-13H,5-7H2,1-4H3
InChIKeyYUHOLEQMHFEKMO-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(oxan-4-yl)-N-[1-(oxolan-3-yl)ethyl]ethanamine
CID 115724018
1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]ethanamine
CID 115677339
3-[[(1R)-1-cycloheptylethyl]amino]-2-methylbutan-2-ol
CID 81389207
2-hydroxy-2-methyl-N-[1-(oxolan-3-yl)ethyl]propanamide
CID 103430535
methyl 2-[1-(oxolan-3-yl)ethylamino]propanoate
CID 115660027
N-[1-(oxolan-3-yl)ethyl]hexan-3-amine
CID 115888979
1-cyclopropyl-N-[1-(oxolan-3-yl)ethyl]propan-1-amine
CID 115724005
1-methylsulfanyl-N-[1-(oxolan-3-yl)ethyl]propan-2-amine
CID 115721709
3-methyl-2-[1-(oxolan-3-yl)ethylamino]butanamide
CID 103707651
2-[1-(oxolan-3-yl)ethylamino]butanamide
CID 115660058
5-methyl-N-[1-(oxolan-3-yl)ethyl]heptan-3-amine
CID 115723984
4-methyl-N-[1-(oxolan-3-yl)ethyl]hexan-2-amine
CID 115892028

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol?
The IUPAC name of 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol (CID 115919249) is 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol.
What is the SMILES notation for 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol?
The canonical SMILES for 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol is CC(NC(C)C(C)(C)O)C1CCOC1.
What is the InChIKey of 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol?
The InChIKey is YUHOLEQMHFEKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-8(10-5-6-14-7-10)12-9(2)11(3,4)13/h8-10,12-13H,5-7H2,1-4H3.
What are the key properties of 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol?
2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol has a molecular weight of 201.31 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[1-(oxolan-3-yl)ethylamino]butan-2-ol is sourced from PubChem (CID 115919249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).