3,4-bis(fluoromethyl)pyridin-2-amine

C7H8F2N2 — CID 175739414

IUPAC3,4-bis(fluoromethyl)pyridin-2-amine
SMILESNc1nccc(CF)c1CF
InChIInChI=1S/C7H8F2N2/c8-3-5-1-2-11-7(10)6(5)4-9/h1-2H,3-4H2,(H2,10,11)
InChIKeyPIHHGPHRBGUZGP-UHFFFAOYSA-N
MW158.15 g/mol
LogP1.60
Rot. Bonds2

About 3,4-bis(fluoromethyl)pyridin-2-amine

3,4-bis(fluoromethyl)pyridin-2-amine (PubChem CID 175739414) has the molecular formula C7H8F2N2 and a molecular weight of 158.15 g/mol. Its IUPAC name is 3,4-bis(fluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name3,4-bis(fluoromethyl)pyridin-2-amine
PubChem CID175739414
Molecular FormulaC7H8F2N2
Molecular Weight158.15 g/mol
Exact Mass158.07
IUPAC Name3,4-bis(fluoromethyl)pyridin-2-amine
SMILESNc1nccc(CF)c1CF
InChIInChI=1S/C7H8F2N2/c8-3-5-1-2-11-7(10)6(5)4-9/h1-2H,3-4H2,(H2,10,11)
InChIKeyPIHHGPHRBGUZGP-UHFFFAOYSA-N
XLogP1.60
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.15
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-bis(fluoromethyl)pyridin-2-amine?
The IUPAC name of 3,4-bis(fluoromethyl)pyridin-2-amine (CID 175739414) is 3,4-bis(fluoromethyl)pyridin-2-amine.
What is the SMILES notation for 3,4-bis(fluoromethyl)pyridin-2-amine?
The canonical SMILES for 3,4-bis(fluoromethyl)pyridin-2-amine is Nc1nccc(CF)c1CF.
What is the InChIKey of 3,4-bis(fluoromethyl)pyridin-2-amine?
The InChIKey is PIHHGPHRBGUZGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2/c8-3-5-1-2-11-7(10)6(5)4-9/h1-2H,3-4H2,(H2,10,11).
What are the key properties of 3,4-bis(fluoromethyl)pyridin-2-amine?
3,4-bis(fluoromethyl)pyridin-2-amine has a molecular weight of 158.15 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-bis(fluoromethyl)pyridin-2-amine is sourced from PubChem (CID 175739414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).