5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine

C17H19N3O — CID 10731528

IUPAC5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine
SMILESCCCN(c1ccncc1)n1ccc2cc(OC)ccc21
InChIInChI=1S/C17H19N3O/c1-3-11-19(15-6-9-18-10-7-15)20-12-8-14-13-16(21-2)4-5-17(14)20/h4-10,12-13H,3,11H2,1-2H3
InChIKeySYFFAEMYTWTOCA-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.72
Rot. Bonds5

About 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine

5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine (PubChem CID 10731528) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine.

Molecular Properties

Compound Name5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine
PubChem CID10731528
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine
SMILESCCCN(c1ccncc1)n1ccc2cc(OC)ccc21
InChIInChI=1S/C17H19N3O/c1-3-11-19(15-6-9-18-10-7-15)20-12-8-14-13-16(21-2)4-5-17(14)20/h4-10,12-13H,3,11H2,1-2H3
InChIKeySYFFAEMYTWTOCA-UHFFFAOYSA-N
XLogP3.72
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine?
The IUPAC name of 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine (CID 10731528) is 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine.
What is the SMILES notation for 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine?
The canonical SMILES for 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine is CCCN(c1ccncc1)n1ccc2cc(OC)ccc21.
What is the InChIKey of 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine?
The InChIKey is SYFFAEMYTWTOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-3-11-19(15-6-9-18-10-7-15)20-12-8-14-13-16(21-2)4-5-17(14)20/h4-10,12-13H,3,11H2,1-2H3.
What are the key properties of 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine?
5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine has a molecular weight of 281.36 g/mol, XLogP of 3.72, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-propyl-N-pyridin-4-ylindol-1-amine is sourced from PubChem (CID 10731528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).