(3R)-1-(difluoromethoxy)pentan-3-amine

C6H13F2NO — CID 169266139

IUPAC(3R)-1-(difluoromethoxy)pentan-3-amine
SMILESCC[C@@H](N)CCOC(F)F
InChIInChI=1S/C6H13F2NO/c1-2-5(9)3-4-10-6(7)8/h5-6H,2-4,9H2,1H3/t5-/m1/s1
InChIKeyDLQDVPLKFXGLHH-RXMQYKEDSA-N
MW153.17 g/mol
LogP1.35
Rot. Bonds5

About (3R)-1-(difluoromethoxy)pentan-3-amine

(3R)-1-(difluoromethoxy)pentan-3-amine (PubChem CID 169266139) has the molecular formula C6H13F2NO and a molecular weight of 153.17 g/mol. Its IUPAC name is (3R)-1-(difluoromethoxy)pentan-3-amine.

Molecular Properties

Compound Name(3R)-1-(difluoromethoxy)pentan-3-amine
PubChem CID169266139
Molecular FormulaC6H13F2NO
Molecular Weight153.17 g/mol
Exact Mass153.10
IUPAC Name(3R)-1-(difluoromethoxy)pentan-3-amine
SMILESCC[C@@H](N)CCOC(F)F
InChIInChI=1S/C6H13F2NO/c1-2-5(9)3-4-10-6(7)8/h5-6H,2-4,9H2,1H3/t5-/m1/s1
InChIKeyDLQDVPLKFXGLHH-RXMQYKEDSA-N
XLogP1.35
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.17
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3R)-1-(difluoromethoxy)pentan-3-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 (3R)-1-(difluoromethoxy)pentan-3-amine?
The IUPAC name of (3R)-1-(difluoromethoxy)pentan-3-amine (CID 169266139) is (3R)-1-(difluoromethoxy)pentan-3-amine.
What is the SMILES notation for (3R)-1-(difluoromethoxy)pentan-3-amine?
The canonical SMILES for (3R)-1-(difluoromethoxy)pentan-3-amine is CC[C@@H](N)CCOC(F)F.
What is the InChIKey of (3R)-1-(difluoromethoxy)pentan-3-amine?
The InChIKey is DLQDVPLKFXGLHH-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H13F2NO/c1-2-5(9)3-4-10-6(7)8/h5-6H,2-4,9H2,1H3/t5-/m1/s1.
What are the key properties of (3R)-1-(difluoromethoxy)pentan-3-amine?
(3R)-1-(difluoromethoxy)pentan-3-amine has a molecular weight of 153.17 g/mol, XLogP of 1.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(difluoromethoxy)pentan-3-amine is sourced from PubChem (CID 169266139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).