(2R)-1-(3-fluorooxetan-3-yl)butan-2-amine

C7H14FNO — CID 170383317

IUPAC(2R)-1-(3-fluorooxetan-3-yl)butan-2-amine
SMILESCC[C@@H](N)CC1(F)COC1
InChIInChI=1S/C7H14FNO/c1-2-6(9)3-7(8)4-10-5-7/h6H,2-5,9H2,1H3/t6-/m1/s1
InChIKeyDUYKBIGNCUWHQK-ZCFIWIBFSA-N
MW147.19 g/mol
LogP0.85
Rot. Bonds3

About (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine

(2R)-1-(3-fluorooxetan-3-yl)butan-2-amine (PubChem CID 170383317) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine.

Molecular Properties

Compound Name(2R)-1-(3-fluorooxetan-3-yl)butan-2-amine
PubChem CID170383317
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name(2R)-1-(3-fluorooxetan-3-yl)butan-2-amine
SMILESCC[C@@H](N)CC1(F)COC1
InChIInChI=1S/C7H14FNO/c1-2-6(9)3-7(8)4-10-5-7/h6H,2-5,9H2,1H3/t6-/m1/s1
InChIKeyDUYKBIGNCUWHQK-ZCFIWIBFSA-N
XLogP0.85
TPSA35.25 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 ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine?
The IUPAC name of (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine (CID 170383317) is (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine.
What is the SMILES notation for (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine?
The canonical SMILES for (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine is CC[C@@H](N)CC1(F)COC1.
What is the InChIKey of (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine?
The InChIKey is DUYKBIGNCUWHQK-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H14FNO/c1-2-6(9)3-7(8)4-10-5-7/h6H,2-5,9H2,1H3/t6-/m1/s1.
What are the key properties of (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine?
(2R)-1-(3-fluorooxetan-3-yl)butan-2-amine has a molecular weight of 147.19 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(3-fluorooxetan-3-yl)butan-2-amine is sourced from PubChem (CID 170383317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).