4-[di(propan-2-yl)amino]oxolan-3-ol

C10H21NO2 — CID 22975502

IUPAC4-[di(propan-2-yl)amino]oxolan-3-ol
SMILESCC(C)N(C(C)C)C1COCC1O
InChIInChI=1S/C10H21NO2/c1-7(2)11(8(3)4)9-5-13-6-10(9)12/h7-10,12H,5-6H2,1-4H3
InChIKeyRXGMAQUHJVXVJO-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.86
Rot. Bonds3

About 4-[di(propan-2-yl)amino]oxolan-3-ol

4-[di(propan-2-yl)amino]oxolan-3-ol (PubChem CID 22975502) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 4-[di(propan-2-yl)amino]oxolan-3-ol.

Molecular Properties

Compound Name4-[di(propan-2-yl)amino]oxolan-3-ol
PubChem CID22975502
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name4-[di(propan-2-yl)amino]oxolan-3-ol
SMILESCC(C)N(C(C)C)C1COCC1O
InChIInChI=1S/C10H21NO2/c1-7(2)11(8(3)4)9-5-13-6-10(9)12/h7-10,12H,5-6H2,1-4H3
InChIKeyRXGMAQUHJVXVJO-UHFFFAOYSA-N
XLogP0.86
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[di(propan-2-yl)amino]oxolan-3-ol?
The IUPAC name of 4-[di(propan-2-yl)amino]oxolan-3-ol (CID 22975502) is 4-[di(propan-2-yl)amino]oxolan-3-ol.
What is the SMILES notation for 4-[di(propan-2-yl)amino]oxolan-3-ol?
The canonical SMILES for 4-[di(propan-2-yl)amino]oxolan-3-ol is CC(C)N(C(C)C)C1COCC1O.
What is the InChIKey of 4-[di(propan-2-yl)amino]oxolan-3-ol?
The InChIKey is RXGMAQUHJVXVJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-7(2)11(8(3)4)9-5-13-6-10(9)12/h7-10,12H,5-6H2,1-4H3.
What are the key properties of 4-[di(propan-2-yl)amino]oxolan-3-ol?
4-[di(propan-2-yl)amino]oxolan-3-ol has a molecular weight of 187.28 g/mol, XLogP of 0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[di(propan-2-yl)amino]oxolan-3-ol is sourced from PubChem (CID 22975502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).