3-methyl-1-(pyridin-4-ylamino)indol-5-ol

C14H13N3O — CID 19072385

IUPAC3-methyl-1-(pyridin-4-ylamino)indol-5-ol
SMILESCc1cn(Nc2ccncc2)c2ccc(O)cc12
InChIInChI=1S/C14H13N3O/c1-10-9-17(16-11-4-6-15-7-5-11)14-3-2-12(18)8-13(10)14/h2-9,18H,1H3,(H,15,16)
InChIKeyVUAIXYZNGSCECU-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.93
Rot. Bonds2

About 3-methyl-1-(pyridin-4-ylamino)indol-5-ol

3-methyl-1-(pyridin-4-ylamino)indol-5-ol (PubChem CID 19072385) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 3-methyl-1-(pyridin-4-ylamino)indol-5-ol.

Molecular Properties

Compound Name3-methyl-1-(pyridin-4-ylamino)indol-5-ol
PubChem CID19072385
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name3-methyl-1-(pyridin-4-ylamino)indol-5-ol
SMILESCc1cn(Nc2ccncc2)c2ccc(O)cc12
InChIInChI=1S/C14H13N3O/c1-10-9-17(16-11-4-6-15-7-5-11)14-3-2-12(18)8-13(10)14/h2-9,18H,1H3,(H,15,16)
InChIKeyVUAIXYZNGSCECU-UHFFFAOYSA-N
XLogP2.93
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(pyridin-4-ylamino)indol-5-ol?
The IUPAC name of 3-methyl-1-(pyridin-4-ylamino)indol-5-ol (CID 19072385) is 3-methyl-1-(pyridin-4-ylamino)indol-5-ol.
What is the SMILES notation for 3-methyl-1-(pyridin-4-ylamino)indol-5-ol?
The canonical SMILES for 3-methyl-1-(pyridin-4-ylamino)indol-5-ol is Cc1cn(Nc2ccncc2)c2ccc(O)cc12.
What is the InChIKey of 3-methyl-1-(pyridin-4-ylamino)indol-5-ol?
The InChIKey is VUAIXYZNGSCECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-10-9-17(16-11-4-6-15-7-5-11)14-3-2-12(18)8-13(10)14/h2-9,18H,1H3,(H,15,16).
What are the key properties of 3-methyl-1-(pyridin-4-ylamino)indol-5-ol?
3-methyl-1-(pyridin-4-ylamino)indol-5-ol has a molecular weight of 239.28 g/mol, XLogP of 2.93, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(pyridin-4-ylamino)indol-5-ol is sourced from PubChem (CID 19072385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).