(2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine

C11H19F2NO — CID 129348543

IUPAC(2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine
SMILESC[C@H]1OCC[C@@]1(C)NCC1CC(F)(F)C1
InChIInChI=1S/C11H19F2NO/c1-8-10(2,3-4-15-8)14-7-9-5-11(12,13)6-9/h8-9,14H,3-7H2,1-2H3/t8-,10-/m1/s1
InChIKeyKYEXBOGIUXERSB-PSASIEDQSA-N
MW219.27 g/mol
LogP2.19
Rot. Bonds3

About (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine

(2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine (PubChem CID 129348543) has the molecular formula C11H19F2NO and a molecular weight of 219.27 g/mol. Its IUPAC name is (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine.

Molecular Properties

Compound Name(2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine
PubChem CID129348543
Molecular FormulaC11H19F2NO
Molecular Weight219.27 g/mol
Exact Mass219.14
IUPAC Name(2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine
SMILESC[C@H]1OCC[C@@]1(C)NCC1CC(F)(F)C1
InChIInChI=1S/C11H19F2NO/c1-8-10(2,3-4-15-8)14-7-9-5-11(12,13)6-9/h8-9,14H,3-7H2,1-2H3/t8-,10-/m1/s1
InChIKeyKYEXBOGIUXERSB-PSASIEDQSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine with MolForge

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Related Compounds

N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine
CID 103581449
N-(cyclopent-3-en-1-ylmethyl)-2,3-dimethyloxolan-3-amine
CID 164651458
N-ethyl-2,3-dimethyloxolan-3-amine
CID 103581198
N-(3-fluoropropyl)-2,3-dimethyloxolan-3-amine
CID 103581461
N-[(2-aminocycloheptyl)methyl]-2,3-dimethyloxolan-3-amine
CID 114096172
N-(2,3-dimethyloxolan-3-yl)-N',N'-diethylethane-1,2-diamine
CID 103581353
3-[(2,3-dimethyloxolan-3-yl)amino]-2,2-dimethylpropanenitrile
CID 164656600
N-(2-cyclohexylethyl)-2,3-dimethyloxolan-3-amine
CID 103529185
N-hexyl-2,3-dimethyloxolan-3-amine
CID 103581298
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-2,3-dimethyloxolan-3-amine
CID 114095834
N-(3-ethoxypropyl)-2,3-dimethyloxolan-3-amine
CID 103581457
2,3-dimethyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]oxolan-3-amine
CID 103581336

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine?
The IUPAC name of (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine (CID 129348543) is (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine.
What is the SMILES notation for (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine?
The canonical SMILES for (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine is C[C@H]1OCC[C@@]1(C)NCC1CC(F)(F)C1.
What is the InChIKey of (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine?
The InChIKey is KYEXBOGIUXERSB-PSASIEDQSA-N. The full InChI is InChI=1S/C11H19F2NO/c1-8-10(2,3-4-15-8)14-7-9-5-11(12,13)6-9/h8-9,14H,3-7H2,1-2H3/t8-,10-/m1/s1.
What are the key properties of (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine?
(2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine has a molecular weight of 219.27 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-[(3,3-difluorocyclobutyl)methyl]-2,3-dimethyloxolan-3-amine is sourced from PubChem (CID 129348543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).