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

C14H22Cl2N2O — CID 103286396

IUPAC3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine
SMILESCCCNc1nc(OCC(C)CCC)c(Cl)cc1Cl
InChIInChI=1S/C14H22Cl2N2O/c1-4-6-10(3)9-19-14-12(16)8-11(15)13(18-14)17-7-5-2/h8,10H,4-7,9H2,1-3H3,(H,17,18)
InChIKeyZDUFSASTLNAGBU-UHFFFAOYSA-N
MW305.25 g/mol
LogP5.03
Rot. Bonds8

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

3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine (PubChem CID 103286396) has the molecular formula C14H22Cl2N2O and a molecular weight of 305.25 g/mol. Its IUPAC name is 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine
PubChem CID103286396
Molecular FormulaC14H22Cl2N2O
Molecular Weight305.25 g/mol
Exact Mass304.11
IUPAC Name3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine
SMILESCCCNc1nc(OCC(C)CCC)c(Cl)cc1Cl
InChIInChI=1S/C14H22Cl2N2O/c1-4-6-10(3)9-19-14-12(16)8-11(15)13(18-14)17-7-5-2/h8,10H,4-7,9H2,1-3H3,(H,17,18)
InChIKeyZDUFSASTLNAGBU-UHFFFAOYSA-N
XLogP5.03
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.25
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-6-(3-methylbutan-2-yloxy)-N-propylpyridin-2-amine
CID 102761074
5-[[3,5-dichloro-6-(propylamino)-2-pyridinyl]amino]-2-methylpentan-1-ol
CID 106163265
3,5-dichloro-6-(1-ethoxypropan-2-yloxy)-N-propylpyridin-2-amine
CID 103491550
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-(2-methylpentoxy)-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 103286435
3,5-dichloro-6-(2-cyclopropylethoxy)-N-propylpyridin-2-amine
CID 106207557
3,5-dichloro-6-propan-2-ylsulfanyl-N-propylpyridin-2-amine
CID 102761403
3,5-dichloro-6-[3-(2-methoxyethoxy)propoxy]-N-propylpyridin-2-amine
CID 103408318
3,5-dichloro-N-ethyl-6-pentan-2-yloxypyridin-2-amine
CID 102989506
3,5-dichloro-N-ethyl-6-(4-methylpentoxy)pyridin-2-amine
CID 102760377
3,5-dichloro-N-propyl-6-(2-thiophen-2-ylethoxy)pyridin-2-amine
CID 102760896

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine (CID 103286396) is 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine is CCCNc1nc(OCC(C)CCC)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine?
The InChIKey is ZDUFSASTLNAGBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22Cl2N2O/c1-4-6-10(3)9-19-14-12(16)8-11(15)13(18-14)17-7-5-2/h8,10H,4-7,9H2,1-3H3,(H,17,18).
What are the key properties of 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine?
3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine has a molecular weight of 305.25 g/mol, XLogP of 5.03, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(2-methylpentoxy)-N-propylpyridin-2-amine is sourced from PubChem (CID 103286396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).