2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine

C9H15F2NO — CID 164655201

IUPAC2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine
SMILESNC1(CC(F)F)CCOC1C1CC1
InChIInChI=1S/C9H15F2NO/c10-7(11)5-9(12)3-4-13-8(9)6-1-2-6/h6-8H,1-5,12H2
InChIKeyXKIMVZJJCUEBTK-UHFFFAOYSA-N
MW191.22 g/mol
LogP1.54
Rot. Bonds3

About 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine

2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine (PubChem CID 164655201) has the molecular formula C9H15F2NO and a molecular weight of 191.22 g/mol. Its IUPAC name is 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine
PubChem CID164655201
Molecular FormulaC9H15F2NO
Molecular Weight191.22 g/mol
Exact Mass191.11
IUPAC Name2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine
SMILESNC1(CC(F)F)CCOC1C1CC1
InChIInChI=1S/C9H15F2NO/c10-7(11)5-9(12)3-4-13-8(9)6-1-2-6/h6-8H,1-5,12H2
InChIKeyXKIMVZJJCUEBTK-UHFFFAOYSA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.22
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-3-(2-fluoroethyl)oxolan-3-amine
CID 164649094
2-cyclopropyl-3-propyloxolan-3-amine
CID 104510271
3-(cyclohexylmethyl)-2-cyclopropyloxolan-3-amine
CID 104510320
2-cyclopropyl-3-(oxan-4-ylmethyl)oxolan-3-amine
CID 104510260
2-cyclopropyl-3-heptyloxolan-3-amine
CID 104510276
2-cyclopropyl-3-[2-(2,2,2-trifluoroethoxy)ethyl]oxolan-3-amine
CID 104510321
2-cyclopropyl-3-(4-methoxybutyl)oxolan-3-amine
CID 104650505
2-cyclopropyl-3-(2-propoxyethyl)oxolan-3-amine
CID 106459238
3-[(3-bromo-5-fluorophenyl)methyl]-2-cyclopropyloxolan-3-amine
CID 113420895
2-cyclopropyl-3-(3-ethylsulfonylpropyl)oxolan-3-amine
CID 113420901
2-cyclopropyl-3-(3-methoxy-3-methylbutyl)oxolan-3-amine
CID 103017197
2-cyclopropyl-3-(2-propylsulfonylethyl)oxolan-3-amine
CID 106733925

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine?
The IUPAC name of 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine (CID 164655201) is 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine.
What is the SMILES notation for 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine?
The canonical SMILES for 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine is NC1(CC(F)F)CCOC1C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine?
The InChIKey is XKIMVZJJCUEBTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO/c10-7(11)5-9(12)3-4-13-8(9)6-1-2-6/h6-8H,1-5,12H2.
What are the key properties of 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine?
2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine has a molecular weight of 191.22 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(2,2-difluoroethyl)oxolan-3-amine is sourced from PubChem (CID 164655201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).