6-butoxy-3,5-dichloro-N-methylpyridin-2-amine

C10H14Cl2N2O — CID 102760529

IUPAC6-butoxy-3,5-dichloro-N-methylpyridin-2-amine
SMILESCCCCOc1nc(NC)c(Cl)cc1Cl
InChIInChI=1S/C10H14Cl2N2O/c1-3-4-5-15-10-8(12)6-7(11)9(13-2)14-10/h6H,3-5H2,1-2H3,(H,13,14)
InChIKeyNZNIAMDFFBKDRF-UHFFFAOYSA-N
MW249.14 g/mol
LogP3.61
Rot. Bonds5

About 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine

6-butoxy-3,5-dichloro-N-methylpyridin-2-amine (PubChem CID 102760529) has the molecular formula C10H14Cl2N2O and a molecular weight of 249.14 g/mol. Its IUPAC name is 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-butoxy-3,5-dichloro-N-methylpyridin-2-amine
PubChem CID102760529
Molecular FormulaC10H14Cl2N2O
Molecular Weight249.14 g/mol
Exact Mass248.05
IUPAC Name6-butoxy-3,5-dichloro-N-methylpyridin-2-amine
SMILESCCCCOc1nc(NC)c(Cl)cc1Cl
InChIInChI=1S/C10H14Cl2N2O/c1-3-4-5-15-10-8(12)6-7(11)9(13-2)14-10/h6H,3-5H2,1-2H3,(H,13,14)
InChIKeyNZNIAMDFFBKDRF-UHFFFAOYSA-N
XLogP3.61
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.14
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(3,5-dichloro-6-pentoxy-2-pyridinyl)hydrazine
CID 102762767
6-(2-butoxyethoxy)-3,5-dichloro-N-ethylpyridin-2-amine
CID 102760364
3,5-dichloro-N-ethyl-6-(4-methylpentoxy)pyridin-2-amine
CID 102760377
3,5-dichloro-N-methyl-6-(2,4,5-trichlorophenoxy)pyridin-2-amine
CID 102760562
3,5-dichloro-6-N-decyl-2-N-methylpyridine-2,6-diamine
CID 102759054
3,5-dichloro-6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 102760859
3,5-dichloro-6-[3-(2-methoxyethoxy)propoxy]-N-propylpyridin-2-amine
CID 103408318
3,5-dichloro-N-ethyl-6-(4,4,4-trifluorobutoxy)pyridin-2-amine
CID 102761118
3,5-dichloro-6-N-(3-ethoxypropyl)-2-N-methylpyridine-2,6-diamine
CID 102755734
3,5-dichloro-6-(2-cyclopropylethoxy)-N-propylpyridin-2-amine
CID 106207557
3,5-dichloro-6-(4-ethyl-2-methoxyphenoxy)-N-methylpyridin-2-amine
CID 107669668
6-but-3-ynoxy-3,5-dichloro-N-ethylpyridin-2-amine
CID 106795649

Frequently Asked Questions

What is the IUPAC name of 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine?
The IUPAC name of 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine (CID 102760529) is 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine.
What is the SMILES notation for 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine?
The canonical SMILES for 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine is CCCCOc1nc(NC)c(Cl)cc1Cl.
What is the InChIKey of 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine?
The InChIKey is NZNIAMDFFBKDRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N2O/c1-3-4-5-15-10-8(12)6-7(11)9(13-2)14-10/h6H,3-5H2,1-2H3,(H,13,14).
What are the key properties of 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine?
6-butoxy-3,5-dichloro-N-methylpyridin-2-amine has a molecular weight of 249.14 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butoxy-3,5-dichloro-N-methylpyridin-2-amine is sourced from PubChem (CID 102760529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).