N-(2-fluoroethyl)-2-methyloxolan-3-amine

C7H14FNO — CID 82725574

IUPACN-(2-fluoroethyl)-2-methyloxolan-3-amine
SMILESCC1OCCC1NCCF
InChIInChI=1S/C7H14FNO/c1-6-7(2-5-10-6)9-4-3-8/h6-7,9H,2-5H2,1H3
InChIKeyIGROBDDIPQARSG-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.72
Rot. Bonds3

About N-(2-fluoroethyl)-2-methyloxolan-3-amine

N-(2-fluoroethyl)-2-methyloxolan-3-amine (PubChem CID 82725574) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is N-(2-fluoroethyl)-2-methyloxolan-3-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-2-methyloxolan-3-amine
PubChem CID82725574
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC NameN-(2-fluoroethyl)-2-methyloxolan-3-amine
SMILESCC1OCCC1NCCF
InChIInChI=1S/C7H14FNO/c1-6-7(2-5-10-6)9-4-3-8/h6-7,9H,2-5H2,1H3
InChIKeyIGROBDDIPQARSG-UHFFFAOYSA-N
XLogP0.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-2-methyloxolan-3-amine?
The IUPAC name of N-(2-fluoroethyl)-2-methyloxolan-3-amine (CID 82725574) is N-(2-fluoroethyl)-2-methyloxolan-3-amine.
What is the SMILES notation for N-(2-fluoroethyl)-2-methyloxolan-3-amine?
The canonical SMILES for N-(2-fluoroethyl)-2-methyloxolan-3-amine is CC1OCCC1NCCF.
What is the InChIKey of N-(2-fluoroethyl)-2-methyloxolan-3-amine?
The InChIKey is IGROBDDIPQARSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-6-7(2-5-10-6)9-4-3-8/h6-7,9H,2-5H2,1H3.
What are the key properties of N-(2-fluoroethyl)-2-methyloxolan-3-amine?
N-(2-fluoroethyl)-2-methyloxolan-3-amine has a molecular weight of 147.19 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-2-methyloxolan-3-amine is sourced from PubChem (CID 82725574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).