3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine

C10H11F3N2O — CID 126763856

IUPAC3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine
SMILESNC1(c2ccc(C(F)(F)F)cn2)CCOC1
InChIInChI=1S/C10H11F3N2O/c11-10(12,13)7-1-2-8(15-5-7)9(14)3-4-16-6-9/h1-2,5H,3-4,6,14H2
InChIKeyNFAHWRPDKSIDDM-UHFFFAOYSA-N
MW232.20 g/mol
LogP1.67
Rot. Bonds1

About 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine

3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine (PubChem CID 126763856) has the molecular formula C10H11F3N2O and a molecular weight of 232.20 g/mol. Its IUPAC name is 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine.

Molecular Properties

Compound Name3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine
PubChem CID126763856
Molecular FormulaC10H11F3N2O
Molecular Weight232.20 g/mol
Exact Mass232.08
IUPAC Name3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine
SMILESNC1(c2ccc(C(F)(F)F)cn2)CCOC1
InChIInChI=1S/C10H11F3N2O/c11-10(12,13)7-1-2-8(15-5-7)9(14)3-4-16-6-9/h1-2,5H,3-4,6,14H2
InChIKeyNFAHWRPDKSIDDM-UHFFFAOYSA-N
XLogP1.67
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine?
The IUPAC name of 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine (CID 126763856) is 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine.
What is the SMILES notation for 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine?
The canonical SMILES for 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine is NC1(c2ccc(C(F)(F)F)cn2)CCOC1.
What is the InChIKey of 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine?
The InChIKey is NFAHWRPDKSIDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O/c11-10(12,13)7-1-2-8(15-5-7)9(14)3-4-16-6-9/h1-2,5H,3-4,6,14H2.
What are the key properties of 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine?
3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine has a molecular weight of 232.20 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(trifluoromethyl)-2-pyridinyl]oxolan-3-amine is sourced from PubChem (CID 126763856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).