1-[(2-methyloxolan-3-yl)amino]propan-2-ol

C8H17NO2 — CID 75525152

IUPAC1-[(2-methyloxolan-3-yl)amino]propan-2-ol
SMILESCC(O)CNC1CCOC1C
InChIInChI=1S/C8H17NO2/c1-6(10)5-9-8-3-4-11-7(8)2/h6-10H,3-5H2,1-2H3
InChIKeyLCGVKNFFKCRMLR-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.13
Rot. Bonds3

About 1-[(2-methyloxolan-3-yl)amino]propan-2-ol

1-[(2-methyloxolan-3-yl)amino]propan-2-ol (PubChem CID 75525152) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 1-[(2-methyloxolan-3-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[(2-methyloxolan-3-yl)amino]propan-2-ol
PubChem CID75525152
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name1-[(2-methyloxolan-3-yl)amino]propan-2-ol
SMILESCC(O)CNC1CCOC1C
InChIInChI=1S/C8H17NO2/c1-6(10)5-9-8-3-4-11-7(8)2/h6-10H,3-5H2,1-2H3
InChIKeyLCGVKNFFKCRMLR-UHFFFAOYSA-N
XLogP0.13
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-methyloxolan-3-yl)amino]propan-2-ol?
The IUPAC name of 1-[(2-methyloxolan-3-yl)amino]propan-2-ol (CID 75525152) is 1-[(2-methyloxolan-3-yl)amino]propan-2-ol.
What is the SMILES notation for 1-[(2-methyloxolan-3-yl)amino]propan-2-ol?
The canonical SMILES for 1-[(2-methyloxolan-3-yl)amino]propan-2-ol is CC(O)CNC1CCOC1C.
What is the InChIKey of 1-[(2-methyloxolan-3-yl)amino]propan-2-ol?
The InChIKey is LCGVKNFFKCRMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-6(10)5-9-8-3-4-11-7(8)2/h6-10H,3-5H2,1-2H3.
What are the key properties of 1-[(2-methyloxolan-3-yl)amino]propan-2-ol?
1-[(2-methyloxolan-3-yl)amino]propan-2-ol has a molecular weight of 159.23 g/mol, XLogP of 0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methyloxolan-3-yl)amino]propan-2-ol is sourced from PubChem (CID 75525152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).