4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine

C16H17N3O2 — CID 86730324

IUPAC4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine
SMILESCC(C)Oc1cc2[nH]ccc2cc1Oc1ccnc(N)c1
InChIInChI=1S/C16H17N3O2/c1-10(2)20-15-9-13-11(3-5-18-13)7-14(15)21-12-4-6-19-16(17)8-12/h3-10,18H,1-2H3,(H2,17,19)
InChIKeyJUWYWJMRHGBWHB-UHFFFAOYSA-N
MW283.33 g/mol
LogP3.72
Rot. Bonds4

About 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine

4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine (PubChem CID 86730324) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine.

Molecular Properties

Compound Name4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine
PubChem CID86730324
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine
SMILESCC(C)Oc1cc2[nH]ccc2cc1Oc1ccnc(N)c1
InChIInChI=1S/C16H17N3O2/c1-10(2)20-15-9-13-11(3-5-18-13)7-14(15)21-12-4-6-19-16(17)8-12/h3-10,18H,1-2H3,(H2,17,19)
InChIKeyJUWYWJMRHGBWHB-UHFFFAOYSA-N
XLogP3.72
TPSA73.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine?
The IUPAC name of 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine (CID 86730324) is 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine.
What is the SMILES notation for 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine?
The canonical SMILES for 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine is CC(C)Oc1cc2[nH]ccc2cc1Oc1ccnc(N)c1.
What is the InChIKey of 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine?
The InChIKey is JUWYWJMRHGBWHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-10(2)20-15-9-13-11(3-5-18-13)7-14(15)21-12-4-6-19-16(17)8-12/h3-10,18H,1-2H3,(H2,17,19).
What are the key properties of 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine?
4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine has a molecular weight of 283.33 g/mol, XLogP of 3.72, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-propan-2-yloxy-1H-indol-5-yl)oxy]pyridin-2-amine is sourced from PubChem (CID 86730324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).