2-chloro-6-(oxan-2-yl)pyridin-3-amine

C10H13ClN2O — CID 115028133

IUPAC2-chloro-6-(oxan-2-yl)pyridin-3-amine
SMILESNc1ccc(C2CCCCO2)nc1Cl
InChIInChI=1S/C10H13ClN2O/c11-10-7(12)4-5-8(13-10)9-3-1-2-6-14-9/h4-5,9H,1-3,6,12H2
InChIKeyQNRLGXUDECJRAY-UHFFFAOYSA-N
MW212.68 g/mol
LogP2.56
Rot. Bonds1

About 2-chloro-6-(oxan-2-yl)pyridin-3-amine

2-chloro-6-(oxan-2-yl)pyridin-3-amine (PubChem CID 115028133) has the molecular formula C10H13ClN2O and a molecular weight of 212.68 g/mol. Its IUPAC name is 2-chloro-6-(oxan-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-chloro-6-(oxan-2-yl)pyridin-3-amine
PubChem CID115028133
Molecular FormulaC10H13ClN2O
Molecular Weight212.68 g/mol
Exact Mass212.07
IUPAC Name2-chloro-6-(oxan-2-yl)pyridin-3-amine
SMILESNc1ccc(C2CCCCO2)nc1Cl
InChIInChI=1S/C10H13ClN2O/c11-10-7(12)4-5-8(13-10)9-3-1-2-6-14-9/h4-5,9H,1-3,6,12H2
InChIKeyQNRLGXUDECJRAY-UHFFFAOYSA-N
XLogP2.56
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 52.56
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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Related Compounds

methyl 2-chloro-6-(oxan-2-yl)pyridine-3-carboxylate
CID 178200817
2-chloro-6-(oxan-4-yl)pyridin-3-amine
CID 115028136
4-chloro-2-methyl-6-[(2S)-oxan-2-yl]pyridine
CID 162412127
2-(oxan-2-yl)imidazo[1,2-a]pyridin-5-amine
CID 117131895
4-chloro-6-(oxan-2-yl)pyrimidine
CID 172993090
3-methoxy-6-(oxan-2-yl)pyridazine
CID 117105921
2-(oxan-2-yl)-1H-benzimidazol-4-amine
CID 63694577
3-bromo-2-methyl-6-(oxolan-2-yl)pyridine
CID 172992725
4-bromo-6-(oxan-2-yl)pyridazin-3-amine
CID 117105823
4-[(2R)-oxolan-2-yl]-1,3-thiazol-2-amine
CID 86336609
2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine
CID 159971085
4-bromo-3-fluoro-2-(oxan-2-yl)aniline
CID 141454137

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(oxan-2-yl)pyridin-3-amine?
The IUPAC name of 2-chloro-6-(oxan-2-yl)pyridin-3-amine (CID 115028133) is 2-chloro-6-(oxan-2-yl)pyridin-3-amine.
What is the SMILES notation for 2-chloro-6-(oxan-2-yl)pyridin-3-amine?
The canonical SMILES for 2-chloro-6-(oxan-2-yl)pyridin-3-amine is Nc1ccc(C2CCCCO2)nc1Cl.
What is the InChIKey of 2-chloro-6-(oxan-2-yl)pyridin-3-amine?
The InChIKey is QNRLGXUDECJRAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O/c11-10-7(12)4-5-8(13-10)9-3-1-2-6-14-9/h4-5,9H,1-3,6,12H2.
What are the key properties of 2-chloro-6-(oxan-2-yl)pyridin-3-amine?
2-chloro-6-(oxan-2-yl)pyridin-3-amine has a molecular weight of 212.68 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(oxan-2-yl)pyridin-3-amine is sourced from PubChem (CID 115028133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).