1-(1H-indol-5-yl)propan-2-amine

C11H14N2 — CID 55253543

IUPAC1-(1H-indol-5-yl)propan-2-amine
SMILESCC(N)Cc1ccc2[nH]ccc2c1
InChIInChI=1S/C11H14N2/c1-8(12)6-9-2-3-11-10(7-9)4-5-13-11/h2-5,7-8,13H,6,12H2,1H3
InChIKeyAULGMISRJWGTBA-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.06
Rot. Bonds2

About 1-(1H-indol-5-yl)propan-2-amine

1-(1H-indol-5-yl)propan-2-amine (PubChem CID 55253543) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 1-(1H-indol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1H-indol-5-yl)propan-2-amine
PubChem CID55253543
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name1-(1H-indol-5-yl)propan-2-amine
SMILESCC(N)Cc1ccc2[nH]ccc2c1
InChIInChI=1S/C11H14N2/c1-8(12)6-9-2-3-11-10(7-9)4-5-13-11/h2-5,7-8,13H,6,12H2,1H3
InChIKeyAULGMISRJWGTBA-UHFFFAOYSA-N
XLogP2.06
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-5-yl)propan-2-amine?
The IUPAC name of 1-(1H-indol-5-yl)propan-2-amine (CID 55253543) is 1-(1H-indol-5-yl)propan-2-amine.
What is the SMILES notation for 1-(1H-indol-5-yl)propan-2-amine?
The canonical SMILES for 1-(1H-indol-5-yl)propan-2-amine is CC(N)Cc1ccc2[nH]ccc2c1.
What is the InChIKey of 1-(1H-indol-5-yl)propan-2-amine?
The InChIKey is AULGMISRJWGTBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-8(12)6-9-2-3-11-10(7-9)4-5-13-11/h2-5,7-8,13H,6,12H2,1H3.
What are the key properties of 1-(1H-indol-5-yl)propan-2-amine?
1-(1H-indol-5-yl)propan-2-amine has a molecular weight of 174.25 g/mol, XLogP of 2.06, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-5-yl)propan-2-amine is sourced from PubChem (CID 55253543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).