6-chloro-2-piperidin-4-ylpyridin-3-amine

C10H14ClN3 — CID 169253686

IUPAC6-chloro-2-piperidin-4-ylpyridin-3-amine
SMILESNc1ccc(Cl)nc1C1CCNCC1
InChIInChI=1S/C10H14ClN3/c11-9-2-1-8(12)10(14-9)7-3-5-13-6-4-7/h1-2,7,13H,3-6,12H2
InChIKeyQALVDDHVLJQDHC-UHFFFAOYSA-N
MW211.70 g/mol
LogP1.78
Rot. Bonds1

About 6-chloro-2-piperidin-4-ylpyridin-3-amine

6-chloro-2-piperidin-4-ylpyridin-3-amine (PubChem CID 169253686) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is 6-chloro-2-piperidin-4-ylpyridin-3-amine.

Molecular Properties

Compound Name6-chloro-2-piperidin-4-ylpyridin-3-amine
PubChem CID169253686
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC Name6-chloro-2-piperidin-4-ylpyridin-3-amine
SMILESNc1ccc(Cl)nc1C1CCNCC1
InChIInChI=1S/C10H14ClN3/c11-9-2-1-8(12)10(14-9)7-3-5-13-6-4-7/h1-2,7,13H,3-6,12H2
InChIKeyQALVDDHVLJQDHC-UHFFFAOYSA-N
XLogP1.78
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-piperidin-4-ylpyridin-3-amine?
The IUPAC name of 6-chloro-2-piperidin-4-ylpyridin-3-amine (CID 169253686) is 6-chloro-2-piperidin-4-ylpyridin-3-amine.
What is the SMILES notation for 6-chloro-2-piperidin-4-ylpyridin-3-amine?
The canonical SMILES for 6-chloro-2-piperidin-4-ylpyridin-3-amine is Nc1ccc(Cl)nc1C1CCNCC1.
What is the InChIKey of 6-chloro-2-piperidin-4-ylpyridin-3-amine?
The InChIKey is QALVDDHVLJQDHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3/c11-9-2-1-8(12)10(14-9)7-3-5-13-6-4-7/h1-2,7,13H,3-6,12H2.
What are the key properties of 6-chloro-2-piperidin-4-ylpyridin-3-amine?
6-chloro-2-piperidin-4-ylpyridin-3-amine has a molecular weight of 211.70 g/mol, XLogP of 1.78, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-piperidin-4-ylpyridin-3-amine is sourced from PubChem (CID 169253686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).