3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine

C10H15FN2 — CID 175624755

IUPAC3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine
SMILESCc1nc(N)c(F)c(C(C)C)c1C
InChIInChI=1S/C10H15FN2/c1-5(2)8-6(3)7(4)13-10(12)9(8)11/h5H,1-4H3,(H2,12,13)
InChIKeyPLJXHYFWZHOOCL-UHFFFAOYSA-N
MW182.24 g/mol
LogP2.54
Rot. Bonds1

About 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine

3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine (PubChem CID 175624755) has the molecular formula C10H15FN2 and a molecular weight of 182.24 g/mol. Its IUPAC name is 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine
PubChem CID175624755
Molecular FormulaC10H15FN2
Molecular Weight182.24 g/mol
Exact Mass182.12
IUPAC Name3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine
SMILESCc1nc(N)c(F)c(C(C)C)c1C
InChIInChI=1S/C10H15FN2/c1-5(2)8-6(3)7(4)13-10(12)9(8)11/h5H,1-4H3,(H2,12,13)
InChIKeyPLJXHYFWZHOOCL-UHFFFAOYSA-N
XLogP2.54
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine?
The IUPAC name of 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine (CID 175624755) is 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine?
The canonical SMILES for 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine is Cc1nc(N)c(F)c(C(C)C)c1C.
What is the InChIKey of 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine?
The InChIKey is PLJXHYFWZHOOCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2/c1-5(2)8-6(3)7(4)13-10(12)9(8)11/h5H,1-4H3,(H2,12,13).
What are the key properties of 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine?
3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine has a molecular weight of 182.24 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5,6-dimethyl-4-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 175624755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).