2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine

C15H15N3O — CID 115113815

IUPAC2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine
SMILESCOc1cccc2cc(-c3cc(N)ccn3)n(C)c12
InChIInChI=1S/C15H15N3O/c1-18-13(12-9-11(16)6-7-17-12)8-10-4-3-5-14(19-2)15(10)18/h3-9H,1-2H3,(H2,16,17)
InChIKeyRALSKSYOPLDPBW-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.83
Rot. Bonds2

About 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine

2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine (PubChem CID 115113815) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine.

Molecular Properties

Compound Name2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine
PubChem CID115113815
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine
SMILESCOc1cccc2cc(-c3cc(N)ccn3)n(C)c12
InChIInChI=1S/C15H15N3O/c1-18-13(12-9-11(16)6-7-17-12)8-10-4-3-5-14(19-2)15(10)18/h3-9H,1-2H3,(H2,16,17)
InChIKeyRALSKSYOPLDPBW-UHFFFAOYSA-N
XLogP2.83
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine?
The IUPAC name of 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine (CID 115113815) is 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine.
What is the SMILES notation for 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine?
The canonical SMILES for 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine is COc1cccc2cc(-c3cc(N)ccn3)n(C)c12.
What is the InChIKey of 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine?
The InChIKey is RALSKSYOPLDPBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-18-13(12-9-11(16)6-7-17-12)8-10-4-3-5-14(19-2)15(10)18/h3-9H,1-2H3,(H2,16,17).
What are the key properties of 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine?
2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine has a molecular weight of 253.31 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-1-methylindol-2-yl)pyridin-4-amine is sourced from PubChem (CID 115113815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).