[(1R)-2,2-difluorocyclobutyl]methanamine

C5H9F2N — CID 97295115

IUPAC[(1R)-2,2-difluorocyclobutyl]methanamine
SMILESNC[C@H]1CCC1(F)F
InChIInChI=1S/C5H9F2N/c6-5(7)2-1-4(5)3-8/h4H,1-3,8H2/t4-/m1/s1
InChIKeyMLCCHSZUZDDCAR-SCSAIBSYSA-N
MW121.13 g/mol
LogP0.99
Rot. Bonds1

About [(1R)-2,2-difluorocyclobutyl]methanamine

[(1R)-2,2-difluorocyclobutyl]methanamine (PubChem CID 97295115) has the molecular formula C5H9F2N and a molecular weight of 121.13 g/mol. Its IUPAC name is [(1R)-2,2-difluorocyclobutyl]methanamine.

Molecular Properties

Compound Name[(1R)-2,2-difluorocyclobutyl]methanamine
PubChem CID97295115
Molecular FormulaC5H9F2N
Molecular Weight121.13 g/mol
Exact Mass121.07
IUPAC Name[(1R)-2,2-difluorocyclobutyl]methanamine
SMILESNC[C@H]1CCC1(F)F
InChIInChI=1S/C5H9F2N/c6-5(7)2-1-4(5)3-8/h4H,1-3,8H2/t4-/m1/s1
InChIKeyMLCCHSZUZDDCAR-SCSAIBSYSA-N
XLogP0.99
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.13
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [(1R)-2,2-difluorocyclobutyl]methanamine with MolForge

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

Launch Full Analysis

Related Compounds

Cyclobutylmethylamine
CID 409746
1-(3-Fluorocyclobutyl)methanamine hydrochloride
CID 74889982
2-(3,3-Difluorocyclobutyl)ethan-1-amine hydrochloride
CID 90317583
3-(Difluoromethyl)cyclobutan-1-amine hydrochloride
CID 112756550
(3-Fluoro-3-methylcyclobutyl)methanamine
CID 115011081
(1s,3s)-3-(Trifluoromethyl)cyclobutan-1-amine hydrochloride
CID 119031446
(2,2-Difluorocyclobutyl)methanamine hydrochloride
CID 127263313
1-Cyclobutyl-2,2,2-trifluoroethan-1-amine hydrochloride
CID 135354981
3-(2,2,2-Trifluoroethyl)cyclobutan-1-amine hydrochloride
CID 138040508
1-(3,3-Difluorocyclobutyl)methanamine
CID 45480376
3-(Trifluoromethyl)cyclobutanamine
CID 50989715
(1R,2R)-2-(Trifluoromethyl)cyclobutan-1-amine
CID 52421051

Frequently Asked Questions

What is the IUPAC name of [(1R)-2,2-difluorocyclobutyl]methanamine?
The IUPAC name of [(1R)-2,2-difluorocyclobutyl]methanamine (CID 97295115) is [(1R)-2,2-difluorocyclobutyl]methanamine.
What is the SMILES notation for [(1R)-2,2-difluorocyclobutyl]methanamine?
The canonical SMILES for [(1R)-2,2-difluorocyclobutyl]methanamine is NC[C@H]1CCC1(F)F.
What is the InChIKey of [(1R)-2,2-difluorocyclobutyl]methanamine?
The InChIKey is MLCCHSZUZDDCAR-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H9F2N/c6-5(7)2-1-4(5)3-8/h4H,1-3,8H2/t4-/m1/s1.
What are the key properties of [(1R)-2,2-difluorocyclobutyl]methanamine?
[(1R)-2,2-difluorocyclobutyl]methanamine has a molecular weight of 121.13 g/mol, XLogP of 0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2,2-difluorocyclobutyl]methanamine is sourced from PubChem (CID 97295115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).