1-[(2-methyloxan-4-yl)amino]pentan-2-ol

C11H23NO2 — CID 115898430

IUPAC1-[(2-methyloxan-4-yl)amino]pentan-2-ol
SMILESCCCC(O)CNC1CCOC(C)C1
InChIInChI=1S/C11H23NO2/c1-3-4-11(13)8-12-10-5-6-14-9(2)7-10/h9-13H,3-8H2,1-2H3
InChIKeyAMZPZMOXQQQXSL-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.30
Rot. Bonds5

About 1-[(2-methyloxan-4-yl)amino]pentan-2-ol

1-[(2-methyloxan-4-yl)amino]pentan-2-ol (PubChem CID 115898430) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-[(2-methyloxan-4-yl)amino]pentan-2-ol.

Molecular Properties

Compound Name1-[(2-methyloxan-4-yl)amino]pentan-2-ol
PubChem CID115898430
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-[(2-methyloxan-4-yl)amino]pentan-2-ol
SMILESCCCC(O)CNC1CCOC(C)C1
InChIInChI=1S/C11H23NO2/c1-3-4-11(13)8-12-10-5-6-14-9(2)7-10/h9-13H,3-8H2,1-2H3
InChIKeyAMZPZMOXQQQXSL-UHFFFAOYSA-N
XLogP1.30
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-methyloxan-4-yl)amino]propane-1,2-diol
CID 66177607
1-[(2-methyloxan-4-yl)amino]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 114107829
1-(oxan-3-ylamino)pentan-2-ol
CID 115719380
4-methyl-1-[(2-propyloxan-4-yl)amino]pentan-2-ol
CID 103991084
1-[(1-methylpiperidin-4-yl)amino]pentan-2-ol
CID 115676989
1-(3,4-difluorophenyl)-2-[(2-methyloxan-4-yl)amino]ethanol
CID 103910298
2-methyl-N-(3-propoxypropyl)oxan-4-amine
CID 82942441
1-(cyclopropylamino)-3-(2-methylmorpholin-4-yl)propan-2-ol
CID 43165752
2-[1-(methylamino)butyl]-N-(2-methylpropyl)oxan-4-amine
CID 166696181
2-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]oxan-4-amine
CID 79351790
N-(3-chloro-2-methylprop-2-enyl)-2-methyloxan-4-amine
CID 106438247
1-(2-methyloxan-4-yl)-3-propylurea
CID 103887319

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methyloxan-4-yl)amino]pentan-2-ol?
The IUPAC name of 1-[(2-methyloxan-4-yl)amino]pentan-2-ol (CID 115898430) is 1-[(2-methyloxan-4-yl)amino]pentan-2-ol.
What is the SMILES notation for 1-[(2-methyloxan-4-yl)amino]pentan-2-ol?
The canonical SMILES for 1-[(2-methyloxan-4-yl)amino]pentan-2-ol is CCCC(O)CNC1CCOC(C)C1.
What is the InChIKey of 1-[(2-methyloxan-4-yl)amino]pentan-2-ol?
The InChIKey is AMZPZMOXQQQXSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-3-4-11(13)8-12-10-5-6-14-9(2)7-10/h9-13H,3-8H2,1-2H3.
What are the key properties of 1-[(2-methyloxan-4-yl)amino]pentan-2-ol?
1-[(2-methyloxan-4-yl)amino]pentan-2-ol has a molecular weight of 201.31 g/mol, XLogP of 1.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methyloxan-4-yl)amino]pentan-2-ol is sourced from PubChem (CID 115898430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).