3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine

C13H20Cl2N2O — CID 102761074

IUPAC3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine
SMILESCCCNc1nc(OC(C)C(C)C)c(Cl)cc1Cl
InChIInChI=1S/C13H20Cl2N2O/c1-5-6-16-12-10(14)7-11(15)13(17-12)18-9(4)8(2)3/h7-9H,5-6H2,1-4H3,(H,16,17)
InChIKeyKNZNXRUIWUAUKB-UHFFFAOYSA-N
MW291.22 g/mol
LogP4.63
Rot. Bonds6

About 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine

3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine (PubChem CID 102761074) has the molecular formula C13H20Cl2N2O and a molecular weight of 291.22 g/mol. Its IUPAC name is 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine
PubChem CID102761074
Molecular FormulaC13H20Cl2N2O
Molecular Weight291.22 g/mol
Exact Mass290.10
IUPAC Name3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine
SMILESCCCNc1nc(OC(C)C(C)C)c(Cl)cc1Cl
InChIInChI=1S/C13H20Cl2N2O/c1-5-6-16-12-10(14)7-11(15)13(17-12)18-9(4)8(2)3/h7-9H,5-6H2,1-4H3,(H,16,17)
InChIKeyKNZNXRUIWUAUKB-UHFFFAOYSA-N
XLogP4.63
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.22
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-(1-ethoxypropan-2-yloxy)-N-propylpyridin-2-amine
CID 103491550
3,5-dichloro-N-ethyl-6-pentan-2-yloxypyridin-2-amine
CID 102989506
3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine
CID 103286396
3,5-dichloro-6-propan-2-ylsulfanyl-N-propylpyridin-2-amine
CID 102761403
(3,5-dichloro-6-pentan-2-yloxy-2-pyridinyl)hydrazine
CID 102989713
2-[[3,5-dichloro-6-(propylamino)-2-pyridinyl]sulfanyl]propan-1-ol
CID 102761595
3,5-dichloro-6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 102760859
3,5-dichloro-6-[(4-chlorophenyl)methoxy]-N-propylpyridin-2-amine
CID 102761015
6-(3-methylbutan-2-yloxy)-N,5-dipropylpyrimidin-4-amine
CID 80882614
3,5-dichloro-6-N-[1-(dimethylamino)propan-2-yl]-2-N-propylpyridine-2,6-diamine
CID 102759419
5-[[3,5-dichloro-6-(propylamino)-2-pyridinyl]amino]-2-methylpentan-1-ol
CID 106163265
3,5-dichloro-6-(2,4-difluorophenoxy)-N-propylpyridin-2-amine
CID 102760578

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine (CID 102761074) is 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine is CCCNc1nc(OC(C)C(C)C)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine?
The InChIKey is KNZNXRUIWUAUKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20Cl2N2O/c1-5-6-16-12-10(14)7-11(15)13(17-12)18-9(4)8(2)3/h7-9H,5-6H2,1-4H3,(H,16,17).
What are the key properties of 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine?
3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine has a molecular weight of 291.22 g/mol, XLogP of 4.63, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine is sourced from PubChem (CID 102761074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).