2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine

C15H24N4O — CID 63172030

IUPAC2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine
SMILESNCC(c1cccnc1)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C15H24N4O/c16-10-15(13-2-1-4-17-11-13)19-5-3-14(12-19)18-6-8-20-9-7-18/h1-2,4,11,14-15H,3,5-10,12,16H2
InChIKeyGLMHIRQXSJMXPR-UHFFFAOYSA-N
MW276.38 g/mol
LogP0.49
Rot. Bonds4

About 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine

2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine (PubChem CID 63172030) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine
PubChem CID63172030
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine
SMILESNCC(c1cccnc1)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C15H24N4O/c16-10-15(13-2-1-4-17-11-13)19-5-3-14(12-19)18-6-8-20-9-7-18/h1-2,4,11,14-15H,3,5-10,12,16H2
InChIKeyGLMHIRQXSJMXPR-UHFFFAOYSA-N
XLogP0.49
TPSA54.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine?
The IUPAC name of 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine (CID 63172030) is 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine.
What is the SMILES notation for 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine?
The canonical SMILES for 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine is NCC(c1cccnc1)N1CCC(N2CCOCC2)C1.
What is the InChIKey of 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine?
The InChIKey is GLMHIRQXSJMXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c16-10-15(13-2-1-4-17-11-13)19-5-3-14(12-19)18-6-8-20-9-7-18/h1-2,4,11,14-15H,3,5-10,12,16H2.
What are the key properties of 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine?
2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine has a molecular weight of 276.38 g/mol, XLogP of 0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-morpholin-4-ylpyrrolidin-1-yl)-2-pyridin-3-ylethanamine is sourced from PubChem (CID 63172030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).