3,5-dichloro-N-piperidin-4-ylpyridin-4-amine

C10H13Cl2N3 — CID 134359724

IUPAC3,5-dichloro-N-piperidin-4-ylpyridin-4-amine
SMILESClc1cncc(Cl)c1NC1CCNCC1
InChIInChI=1S/C10H13Cl2N3/c11-8-5-14-6-9(12)10(8)15-7-1-3-13-4-2-7/h5-7,13H,1-4H2,(H,14,15)
InChIKeyRYIWADATUCJLHH-UHFFFAOYSA-N
MW246.14 g/mol
LogP2.55
Rot. Bonds2

About 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine

3,5-dichloro-N-piperidin-4-ylpyridin-4-amine (PubChem CID 134359724) has the molecular formula C10H13Cl2N3 and a molecular weight of 246.14 g/mol. Its IUPAC name is 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine.

Molecular Properties

Compound Name3,5-dichloro-N-piperidin-4-ylpyridin-4-amine
PubChem CID134359724
Molecular FormulaC10H13Cl2N3
Molecular Weight246.14 g/mol
Exact Mass245.05
IUPAC Name3,5-dichloro-N-piperidin-4-ylpyridin-4-amine
SMILESClc1cncc(Cl)c1NC1CCNCC1
InChIInChI=1S/C10H13Cl2N3/c11-8-5-14-6-9(12)10(8)15-7-1-3-13-4-2-7/h5-7,13H,1-4H2,(H,14,15)
InChIKeyRYIWADATUCJLHH-UHFFFAOYSA-N
XLogP2.55
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.14
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine?
The IUPAC name of 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine (CID 134359724) is 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine.
What is the SMILES notation for 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine?
The canonical SMILES for 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine is Clc1cncc(Cl)c1NC1CCNCC1.
What is the InChIKey of 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine?
The InChIKey is RYIWADATUCJLHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2N3/c11-8-5-14-6-9(12)10(8)15-7-1-3-13-4-2-7/h5-7,13H,1-4H2,(H,14,15).
What are the key properties of 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine?
3,5-dichloro-N-piperidin-4-ylpyridin-4-amine has a molecular weight of 246.14 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-piperidin-4-ylpyridin-4-amine is sourced from PubChem (CID 134359724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).