2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine

C15H16Cl2N2 — CID 82452828

IUPAC2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine
SMILESCc1nc(-c2cc(Cl)ccc2Cl)ccc1C(C)(C)N
InChIInChI=1S/C15H16Cl2N2/c1-9-12(15(2,3)18)5-7-14(19-9)11-8-10(16)4-6-13(11)17/h4-8H,18H2,1-3H3
InChIKeyYAGJDZSZQHZCCA-UHFFFAOYSA-N
MW295.21 g/mol
LogP4.56
Rot. Bonds2

About 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine

2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine (PubChem CID 82452828) has the molecular formula C15H16Cl2N2 and a molecular weight of 295.21 g/mol. Its IUPAC name is 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine.

Molecular Properties

Compound Name2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine
PubChem CID82452828
Molecular FormulaC15H16Cl2N2
Molecular Weight295.21 g/mol
Exact Mass294.07
IUPAC Name2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine
SMILESCc1nc(-c2cc(Cl)ccc2Cl)ccc1C(C)(C)N
InChIInChI=1S/C15H16Cl2N2/c1-9-12(15(2,3)18)5-7-14(19-9)11-8-10(16)4-6-13(11)17/h4-8H,18H2,1-3H3
InChIKeyYAGJDZSZQHZCCA-UHFFFAOYSA-N
XLogP4.56
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.21
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine?
The IUPAC name of 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine (CID 82452828) is 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine.
What is the SMILES notation for 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine?
The canonical SMILES for 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine is Cc1nc(-c2cc(Cl)ccc2Cl)ccc1C(C)(C)N.
What is the InChIKey of 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine?
The InChIKey is YAGJDZSZQHZCCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2/c1-9-12(15(2,3)18)5-7-14(19-9)11-8-10(16)4-6-13(11)17/h4-8H,18H2,1-3H3.
What are the key properties of 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine?
2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine has a molecular weight of 295.21 g/mol, XLogP of 4.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]propan-2-amine is sourced from PubChem (CID 82452828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).