6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine

C13H20Cl2N2O2 — CID 102760364

IUPAC6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine
SMILESCCCCOCCOc1nc(NCC)c(Cl)cc1Cl
InChIInChI=1S/C13H20Cl2N2O2/c1-3-5-6-18-7-8-19-13-11(15)9-10(14)12(17-13)16-4-2/h9H,3-8H2,1-2H3,(H,16,17)
InChIKeySJHQDONOGUVEOZ-UHFFFAOYSA-N
MW307.22 g/mol
LogP4.02
Rot. Bonds9

About 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine

6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine (PubChem CID 102760364) has the molecular formula C13H20Cl2N2O2 and a molecular weight of 307.22 g/mol. Its IUPAC name is 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine
PubChem CID102760364
Molecular FormulaC13H20Cl2N2O2
Molecular Weight307.22 g/mol
Exact Mass306.09
IUPAC Name6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine
SMILESCCCCOCCOc1nc(NCC)c(Cl)cc1Cl
InChIInChI=1S/C13H20Cl2N2O2/c1-3-5-6-18-7-8-19-13-11(15)9-10(14)12(17-13)16-4-2/h9H,3-8H2,1-2H3,(H,16,17)
InChIKeySJHQDONOGUVEOZ-UHFFFAOYSA-N
XLogP4.02
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.22
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3,5-dichloro-6-[3-(2-methoxyethoxy)propoxy]-N-propylpyridin-2-amine
CID 103408318
6-butoxy-3,5-dichloro-N-methylpyridin-2-amine
CID 102760529
3,5-dichloro-N-ethyl-6-(4-methylpentoxy)pyridin-2-amine
CID 102760377
3,5-dichloro-N-ethyl-6-(4,4,4-trifluorobutoxy)pyridin-2-amine
CID 102761118
6-but-3-ynoxy-3,5-dichloro-N-ethylpyridin-2-amine
CID 106795649
3,5-dichloro-N-ethyl-6-(3-methoxy-3-methylbutoxy)pyridin-2-amine
CID 106669249
3,5-dichloro-2-N-ethyl-6-N-[4-(2-methoxyethoxy)butyl]pyridine-2,6-diamine
CID 102759816
(3,5-dichloro-6-pentoxy-2-pyridinyl)hydrazine
CID 102762767
6-(2-butoxyethoxy)-N-ethyl-5-propylpyrimidin-4-amine
CID 80861396
3,5-dichloro-6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 102760859
3,5-dichloro-2-N-ethyl-6-N-octan-4-ylpyridine-2,6-diamine
CID 106028744
3,5-dichloro-6-(2-cyclopropylethoxy)-N-propylpyridin-2-amine
CID 106207557

Frequently Asked Questions

What is the IUPAC name of 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine?
The IUPAC name of 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine (CID 102760364) is 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine?
The canonical SMILES for 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine is CCCCOCCOc1nc(NCC)c(Cl)cc1Cl.
What is the InChIKey of 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine?
The InChIKey is SJHQDONOGUVEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20Cl2N2O2/c1-3-5-6-18-7-8-19-13-11(15)9-10(14)12(17-13)16-4-2/h9H,3-8H2,1-2H3,(H,16,17).
What are the key properties of 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine?
6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine has a molecular weight of 307.22 g/mol, XLogP of 4.02, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine is sourced from PubChem (CID 102760364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).