2-(2-butoxyethoxy)-6-chloropyridin-3-amine

C11H17ClN2O2 — CID 115474476

IUPAC2-(2-butoxyethoxy)-6-chloropyridin-3-amine
SMILESCCCCOCCOc1nc(Cl)ccc1N
InChIInChI=1S/C11H17ClN2O2/c1-2-3-6-15-7-8-16-11-9(13)4-5-10(12)14-11/h4-5H,2-3,6-8,13H2,1H3
InChIKeyLIZGDZIEIWMXPV-UHFFFAOYSA-N
MW244.72 g/mol
LogP2.51
Rot. Bonds7

About 2-(2-butoxyethoxy)-6-chloropyridin-3-amine

2-(2-butoxyethoxy)-6-chloropyridin-3-amine (PubChem CID 115474476) has the molecular formula C11H17ClN2O2 and a molecular weight of 244.72 g/mol. Its IUPAC name is 2-(2-butoxyethoxy)-6-chloropyridin-3-amine.

Molecular Properties

Compound Name2-(2-butoxyethoxy)-6-chloropyridin-3-amine
PubChem CID115474476
Molecular FormulaC11H17ClN2O2
Molecular Weight244.72 g/mol
Exact Mass244.10
IUPAC Name2-(2-butoxyethoxy)-6-chloropyridin-3-amine
SMILESCCCCOCCOc1nc(Cl)ccc1N
InChIInChI=1S/C11H17ClN2O2/c1-2-3-6-15-7-8-16-11-9(13)4-5-10(12)14-11/h4-5H,2-3,6-8,13H2,1H3
InChIKeyLIZGDZIEIWMXPV-UHFFFAOYSA-N
XLogP2.51
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-2-heptoxypyridin-3-amine
CID 115474479
6-methoxy-2-(2-propoxyethoxy)pyridin-3-amine
CID 115321149
4-(2-butoxyethoxy)-6-chloropyrimidin-2-amine
CID 80740016
2-[2-(3-methoxypropoxy)ethoxy]-6-methylpyridin-3-amine
CID 103176853
2-(2-butoxyethoxy)pyridine-3,5-diamine
CID 19913402
5-amino-6-butoxypyridine-2-carboxylic acid
CID 114408773
2-[2-(2-methoxyethoxy)ethoxy]-6-methylpyridin-3-amine
CID 104560039
6-chloro-2-(4-propylphenoxy)pyridin-3-amine
CID 115474531
2-(2-butoxyethoxy)-3-chloro-5-(chloromethyl)pyridine
CID 61267855
2-butoxy-3,5-dichloropyridin-4-amine
CID 21388649
6-hexoxy-2-propoxypyridin-3-amine
CID 43262487
4-(2-butoxyethoxy)pyrimidin-2-amine
CID 80861687

Frequently Asked Questions

What is the IUPAC name of 2-(2-butoxyethoxy)-6-chloropyridin-3-amine?
The IUPAC name of 2-(2-butoxyethoxy)-6-chloropyridin-3-amine (CID 115474476) is 2-(2-butoxyethoxy)-6-chloropyridin-3-amine.
What is the SMILES notation for 2-(2-butoxyethoxy)-6-chloropyridin-3-amine?
The canonical SMILES for 2-(2-butoxyethoxy)-6-chloropyridin-3-amine is CCCCOCCOc1nc(Cl)ccc1N.
What is the InChIKey of 2-(2-butoxyethoxy)-6-chloropyridin-3-amine?
The InChIKey is LIZGDZIEIWMXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O2/c1-2-3-6-15-7-8-16-11-9(13)4-5-10(12)14-11/h4-5H,2-3,6-8,13H2,1H3.
What are the key properties of 2-(2-butoxyethoxy)-6-chloropyridin-3-amine?
2-(2-butoxyethoxy)-6-chloropyridin-3-amine has a molecular weight of 244.72 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butoxyethoxy)-6-chloropyridin-3-amine is sourced from PubChem (CID 115474476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).