1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine

C15H17N3 — CID 55054423

IUPAC1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cc(N2CCc3ccccc32)ccn1
InChIInChI=1S/C15H17N3/c1-16-11-13-10-14(6-8-17-13)18-9-7-12-4-2-3-5-15(12)18/h2-6,8,10,16H,7,9,11H2,1H3
InChIKeySGYCBBKPRCVVEB-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.50
Rot. Bonds3

About 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine

1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine (PubChem CID 55054423) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine
PubChem CID55054423
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cc(N2CCc3ccccc32)ccn1
InChIInChI=1S/C15H17N3/c1-16-11-13-10-14(6-8-17-13)18-9-7-12-4-2-3-5-15(12)18/h2-6,8,10,16H,7,9,11H2,1H3
InChIKeySGYCBBKPRCVVEB-UHFFFAOYSA-N
XLogP2.50
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine (CID 55054423) is 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine is CNCc1cc(N2CCc3ccccc32)ccn1.
What is the InChIKey of 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine?
The InChIKey is SGYCBBKPRCVVEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-16-11-13-10-14(6-8-17-13)18-9-7-12-4-2-3-5-15(12)18/h2-6,8,10,16H,7,9,11H2,1H3.
What are the key properties of 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine?
1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine has a molecular weight of 239.32 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,3-dihydroindol-1-yl)-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 55054423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).