2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine

C9H18FNO — CID 170950660

IUPAC2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine
SMILESCC(C)C1CON(CCCF)C1
InChIInChI=1S/C9H18FNO/c1-8(2)9-6-11(12-7-9)5-3-4-10/h8-9H,3-7H2,1-2H3
InChIKeyZFWFZGXOXKFLKB-UHFFFAOYSA-N
MW175.25 g/mol
LogP1.87
Rot. Bonds4

About 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine

2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine (PubChem CID 170950660) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine.

Molecular Properties

Compound Name2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine
PubChem CID170950660
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine
SMILESCC(C)C1CON(CCCF)C1
InChIInChI=1S/C9H18FNO/c1-8(2)9-6-11(12-7-9)5-3-4-10/h8-9H,3-7H2,1-2H3
InChIKeyZFWFZGXOXKFLKB-UHFFFAOYSA-N
XLogP1.87
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine?
The IUPAC name of 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine (CID 170950660) is 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine.
What is the SMILES notation for 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine?
The canonical SMILES for 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine is CC(C)C1CON(CCCF)C1.
What is the InChIKey of 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine?
The InChIKey is ZFWFZGXOXKFLKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c1-8(2)9-6-11(12-7-9)5-3-4-10/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine?
2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine has a molecular weight of 175.25 g/mol, XLogP of 1.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoropropyl)-4-propan-2-yl-1,2-oxazolidine is sourced from PubChem (CID 170950660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).