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

C9H15F2NO — CID 103580778

IUPAC2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine
SMILESFC(F)CNC1CCOC1C1CC1
InChIInChI=1S/C9H15F2NO/c10-8(11)5-12-7-3-4-13-9(7)6-1-2-6/h6-9,12H,1-5H2
InChIKeyRFJFANPBIHMTBF-UHFFFAOYSA-N
MW191.22 g/mol
LogP1.41
Rot. Bonds4

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

2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine (PubChem CID 103580778) has the molecular formula C9H15F2NO and a molecular weight of 191.22 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine
PubChem CID103580778
Molecular FormulaC9H15F2NO
Molecular Weight191.22 g/mol
Exact Mass191.11
IUPAC Name2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine
SMILESFC(F)CNC1CCOC1C1CC1
InChIInChI=1S/C9H15F2NO/c10-8(11)5-12-7-3-4-13-9(7)6-1-2-6/h6-9,12H,1-5H2
InChIKeyRFJFANPBIHMTBF-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.22
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine?
The IUPAC name of 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine (CID 103580778) is 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine.
What is the SMILES notation for 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine?
The canonical SMILES for 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine is FC(F)CNC1CCOC1C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine?
The InChIKey is RFJFANPBIHMTBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO/c10-8(11)5-12-7-3-4-13-9(7)6-1-2-6/h6-9,12H,1-5H2.
What are the key properties of 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine?
2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine has a molecular weight of 191.22 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2,2-difluoroethyl)oxolan-3-amine is sourced from PubChem (CID 103580778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).