2-chloro-6-piperidin-1-ylpyridin-4-amine

C10H14ClN3 — CID 54231451

IUPAC2-chloro-6-piperidin-1-ylpyridin-4-amine
SMILESNc1cc(Cl)nc(N2CCCCC2)c1
InChIInChI=1S/C10H14ClN3/c11-9-6-8(12)7-10(13-9)14-4-2-1-3-5-14/h6-7H,1-5H2,(H2,12,13)
InChIKeyQJNZZBLPEVMPEH-UHFFFAOYSA-N
MW211.70 g/mol
LogP2.31
Rot. Bonds1

About 2-chloro-6-piperidin-1-ylpyridin-4-amine

2-chloro-6-piperidin-1-ylpyridin-4-amine (PubChem CID 54231451) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is 2-chloro-6-piperidin-1-ylpyridin-4-amine.

Molecular Properties

Compound Name2-chloro-6-piperidin-1-ylpyridin-4-amine
PubChem CID54231451
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC Name2-chloro-6-piperidin-1-ylpyridin-4-amine
SMILESNc1cc(Cl)nc(N2CCCCC2)c1
InChIInChI=1S/C10H14ClN3/c11-9-6-8(12)7-10(13-9)14-4-2-1-3-5-14/h6-7H,1-5H2,(H2,12,13)
InChIKeyQJNZZBLPEVMPEH-UHFFFAOYSA-N
XLogP2.31
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 52.31
H-Bond Donors ≤ 51
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 2-chloro-6-piperidin-1-ylpyridin-4-amine?
The IUPAC name of 2-chloro-6-piperidin-1-ylpyridin-4-amine (CID 54231451) is 2-chloro-6-piperidin-1-ylpyridin-4-amine.
What is the SMILES notation for 2-chloro-6-piperidin-1-ylpyridin-4-amine?
The canonical SMILES for 2-chloro-6-piperidin-1-ylpyridin-4-amine is Nc1cc(Cl)nc(N2CCCCC2)c1.
What is the InChIKey of 2-chloro-6-piperidin-1-ylpyridin-4-amine?
The InChIKey is QJNZZBLPEVMPEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3/c11-9-6-8(12)7-10(13-9)14-4-2-1-3-5-14/h6-7H,1-5H2,(H2,12,13).
What are the key properties of 2-chloro-6-piperidin-1-ylpyridin-4-amine?
2-chloro-6-piperidin-1-ylpyridin-4-amine has a molecular weight of 211.70 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-piperidin-1-ylpyridin-4-amine is sourced from PubChem (CID 54231451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).