5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine

C15H15ClN2O — CID 55127792

IUPAC5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine
SMILESNc1ccc(Cl)c(COc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C15H15ClN2O/c16-13-6-7-15(17)18-14(13)9-19-12-5-4-10-2-1-3-11(10)8-12/h4-8H,1-3,9H2,(H2,17,18)
InChIKeyZYEXDKLRAKZDKS-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.38
Rot. Bonds3

About 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine

5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine (PubChem CID 55127792) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine
PubChem CID55127792
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine
SMILESNc1ccc(Cl)c(COc2ccc3c(c2)CCC3)n1
InChIInChI=1S/C15H15ClN2O/c16-13-6-7-15(17)18-14(13)9-19-12-5-4-10-2-1-3-11(10)8-12/h4-8H,1-3,9H2,(H2,17,18)
InChIKeyZYEXDKLRAKZDKS-UHFFFAOYSA-N
XLogP3.38
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine?
The IUPAC name of 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine (CID 55127792) is 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine is Nc1ccc(Cl)c(COc2ccc3c(c2)CCC3)n1.
What is the InChIKey of 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine?
The InChIKey is ZYEXDKLRAKZDKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c16-13-6-7-15(17)18-14(13)9-19-12-5-4-10-2-1-3-11(10)8-12/h4-8H,1-3,9H2,(H2,17,18).
What are the key properties of 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine?
5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine has a molecular weight of 274.75 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine is sourced from PubChem (CID 55127792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).