2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine

C16H26N4O — CID 80637179

IUPAC2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine
SMILESCc1cc(CCN)cnc1N1CCC(N2CCOCC2)C1
InChIInChI=1S/C16H26N4O/c1-13-10-14(2-4-17)11-18-16(13)20-5-3-15(12-20)19-6-8-21-9-7-19/h10-11,15H,2-9,12,17H2,1H3
InChIKeyBKMJVJCHOFTIQQ-UHFFFAOYSA-N
MW290.41 g/mol
LogP0.80
Rot. Bonds4

About 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine

2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine (PubChem CID 80637179) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine.

Molecular Properties

Compound Name2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine
PubChem CID80637179
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine
SMILESCc1cc(CCN)cnc1N1CCC(N2CCOCC2)C1
InChIInChI=1S/C16H26N4O/c1-13-10-14(2-4-17)11-18-16(13)20-5-3-15(12-20)19-6-8-21-9-7-19/h10-11,15H,2-9,12,17H2,1H3
InChIKeyBKMJVJCHOFTIQQ-UHFFFAOYSA-N
XLogP0.80
TPSA54.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine?
The IUPAC name of 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine (CID 80637179) is 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine.
What is the SMILES notation for 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine?
The canonical SMILES for 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine is Cc1cc(CCN)cnc1N1CCC(N2CCOCC2)C1.
What is the InChIKey of 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine?
The InChIKey is BKMJVJCHOFTIQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-13-10-14(2-4-17)11-18-16(13)20-5-3-15(12-20)19-6-8-21-9-7-19/h10-11,15H,2-9,12,17H2,1H3.
What are the key properties of 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine?
2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine has a molecular weight of 290.41 g/mol, XLogP of 0.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-3-pyridinyl]ethanamine is sourced from PubChem (CID 80637179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).