3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine

C9H12F2N2 — CID 169118624

IUPAC3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine
SMILESCC(C)c1ccc(C(F)F)c(N)n1
InChIInChI=1S/C9H12F2N2/c1-5(2)7-4-3-6(8(10)11)9(12)13-7/h3-5,8H,1-2H3,(H2,12,13)
InChIKeyWFFILEKYEITEGV-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.72
Rot. Bonds2

About 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine

3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine (PubChem CID 169118624) has the molecular formula C9H12F2N2 and a molecular weight of 186.21 g/mol. Its IUPAC name is 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine
PubChem CID169118624
Molecular FormulaC9H12F2N2
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine
SMILESCC(C)c1ccc(C(F)F)c(N)n1
InChIInChI=1S/C9H12F2N2/c1-5(2)7-4-3-6(8(10)11)9(12)13-7/h3-5,8H,1-2H3,(H2,12,13)
InChIKeyWFFILEKYEITEGV-UHFFFAOYSA-N
XLogP2.72
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine?
The IUPAC name of 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine (CID 169118624) is 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine?
The canonical SMILES for 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine is CC(C)c1ccc(C(F)F)c(N)n1.
What is the InChIKey of 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine?
The InChIKey is WFFILEKYEITEGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2N2/c1-5(2)7-4-3-6(8(10)11)9(12)13-7/h3-5,8H,1-2H3,(H2,12,13).
What are the key properties of 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine?
3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine has a molecular weight of 186.21 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-6-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 169118624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).