3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine

C6H10F3NO — CID 164536459

IUPAC3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine
SMILESNC(COC1CC1)C(F)(F)F
InChIInChI=1S/C6H10F3NO/c7-6(8,9)5(10)3-11-4-1-2-4/h4-5H,1-3,10H2
InChIKeyJDYKQUJRAHRCIA-UHFFFAOYSA-N
MW169.15 g/mol
LogP1.05
Rot. Bonds3

About 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine

3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine (PubChem CID 164536459) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine.

Molecular Properties

Compound Name3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine
PubChem CID164536459
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine
SMILESNC(COC1CC1)C(F)(F)F
InChIInChI=1S/C6H10F3NO/c7-6(8,9)5(10)3-11-4-1-2-4/h4-5H,1-3,10H2
InChIKeyJDYKQUJRAHRCIA-UHFFFAOYSA-N
XLogP1.05
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine?
The IUPAC name of 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine (CID 164536459) is 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine.
What is the SMILES notation for 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine?
The canonical SMILES for 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine is NC(COC1CC1)C(F)(F)F.
What is the InChIKey of 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine?
The InChIKey is JDYKQUJRAHRCIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO/c7-6(8,9)5(10)3-11-4-1-2-4/h4-5H,1-3,10H2.
What are the key properties of 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine?
3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine has a molecular weight of 169.15 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyloxy-1,1,1-trifluoropropan-2-amine is sourced from PubChem (CID 164536459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).