3,5-dichloro-N-propan-2-ylpyridin-4-amine

C8H10Cl2N2 — CID 23352265

IUPAC3,5-dichloro-N-propan-2-ylpyridin-4-amine
SMILESCC(C)Nc1c(Cl)cncc1Cl
InChIInChI=1S/C8H10Cl2N2/c1-5(2)12-8-6(9)3-11-4-7(8)10/h3-5H,1-2H3,(H,11,12)
InChIKeyAZVHACIZBGDXCK-UHFFFAOYSA-N
MW205.09 g/mol
LogP3.21
Rot. Bonds2

About 3,5-dichloro-N-propan-2-ylpyridin-4-amine

3,5-dichloro-N-propan-2-ylpyridin-4-amine (PubChem CID 23352265) has the molecular formula C8H10Cl2N2 and a molecular weight of 205.09 g/mol. Its IUPAC name is 3,5-dichloro-N-propan-2-ylpyridin-4-amine.

Molecular Properties

Compound Name3,5-dichloro-N-propan-2-ylpyridin-4-amine
PubChem CID23352265
Molecular FormulaC8H10Cl2N2
Molecular Weight205.09 g/mol
Exact Mass204.02
IUPAC Name3,5-dichloro-N-propan-2-ylpyridin-4-amine
SMILESCC(C)Nc1c(Cl)cncc1Cl
InChIInChI=1S/C8H10Cl2N2/c1-5(2)12-8-6(9)3-11-4-7(8)10/h3-5H,1-2H3,(H,11,12)
InChIKeyAZVHACIZBGDXCK-UHFFFAOYSA-N
XLogP3.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.09
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-propan-2-ylpyridin-4-amine?
The IUPAC name of 3,5-dichloro-N-propan-2-ylpyridin-4-amine (CID 23352265) is 3,5-dichloro-N-propan-2-ylpyridin-4-amine.
What is the SMILES notation for 3,5-dichloro-N-propan-2-ylpyridin-4-amine?
The canonical SMILES for 3,5-dichloro-N-propan-2-ylpyridin-4-amine is CC(C)Nc1c(Cl)cncc1Cl.
What is the InChIKey of 3,5-dichloro-N-propan-2-ylpyridin-4-amine?
The InChIKey is AZVHACIZBGDXCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10Cl2N2/c1-5(2)12-8-6(9)3-11-4-7(8)10/h3-5H,1-2H3,(H,11,12).
What are the key properties of 3,5-dichloro-N-propan-2-ylpyridin-4-amine?
3,5-dichloro-N-propan-2-ylpyridin-4-amine has a molecular weight of 205.09 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-propan-2-ylpyridin-4-amine is sourced from PubChem (CID 23352265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).