[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine

C15H17N3 — CID 102545843

IUPAC[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine
SMILESCc1cc(N2CCc3ccccc32)ncc1CN
InChIInChI=1S/C15H17N3/c1-11-8-15(17-10-13(11)9-16)18-7-6-12-4-2-3-5-14(12)18/h2-5,8,10H,6-7,9,16H2,1H3
InChIKeyIPLLTRZPUQSKKB-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.54
Rot. Bonds2

About [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine

[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine (PubChem CID 102545843) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine
PubChem CID102545843
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine
SMILESCc1cc(N2CCc3ccccc32)ncc1CN
InChIInChI=1S/C15H17N3/c1-11-8-15(17-10-13(11)9-16)18-7-6-12-4-2-3-5-14(12)18/h2-5,8,10H,6-7,9,16H2,1H3
InChIKeyIPLLTRZPUQSKKB-UHFFFAOYSA-N
XLogP2.54
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine?
The IUPAC name of [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine (CID 102545843) is [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine?
The canonical SMILES for [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine is Cc1cc(N2CCc3ccccc32)ncc1CN.
What is the InChIKey of [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine?
The InChIKey is IPLLTRZPUQSKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-11-8-15(17-10-13(11)9-16)18-7-6-12-4-2-3-5-14(12)18/h2-5,8,10H,6-7,9,16H2,1H3.
What are the key properties of [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine?
[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine has a molecular weight of 239.32 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine is sourced from PubChem (CID 102545843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).