6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine

C15H16N2O2 — CID 14307268

IUPAC6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine
SMILESCC1CCc2cc(Oc3ccc(N)cn3)ccc2O1
InChIInChI=1S/C15H16N2O2/c1-10-2-3-11-8-13(5-6-14(11)18-10)19-15-7-4-12(16)9-17-15/h4-10H,2-3,16H2,1H3
InChIKeyVWRWHGHXAICPDA-UHFFFAOYSA-N
MW256.31 g/mol
LogP3.17
Rot. Bonds2

About 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine

6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine (PubChem CID 14307268) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine
PubChem CID14307268
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine
SMILESCC1CCc2cc(Oc3ccc(N)cn3)ccc2O1
InChIInChI=1S/C15H16N2O2/c1-10-2-3-11-8-13(5-6-14(11)18-10)19-15-7-4-12(16)9-17-15/h4-10H,2-3,16H2,1H3
InChIKeyVWRWHGHXAICPDA-UHFFFAOYSA-N
XLogP3.17
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_A(8)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine (CID 14307268) is 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine is CC1CCc2cc(Oc3ccc(N)cn3)ccc2O1.
What is the InChIKey of 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine?
The InChIKey is VWRWHGHXAICPDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-2-3-11-8-13(5-6-14(11)18-10)19-15-7-4-12(16)9-17-15/h4-10H,2-3,16H2,1H3.
What are the key properties of 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine?
6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine has a molecular weight of 256.31 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 14307268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).