2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine

C15H25N3O — CID 115239068

IUPAC2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine
SMILESCC(C)(CNCCC1COCCN1)c1ccncc1
InChIInChI=1S/C15H25N3O/c1-15(2,13-3-6-16-7-4-13)12-17-8-5-14-11-19-10-9-18-14/h3-4,6-7,14,17-18H,5,8-12H2,1-2H3
InChIKeyJACWKQXKSOTHEX-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.33
Rot. Bonds6

About 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine

2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine (PubChem CID 115239068) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine
PubChem CID115239068
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine
SMILESCC(C)(CNCCC1COCCN1)c1ccncc1
InChIInChI=1S/C15H25N3O/c1-15(2,13-3-6-16-7-4-13)12-17-8-5-14-11-19-10-9-18-14/h3-4,6-7,14,17-18H,5,8-12H2,1-2H3
InChIKeyJACWKQXKSOTHEX-UHFFFAOYSA-N
XLogP1.33
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine?
The IUPAC name of 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine (CID 115239068) is 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine?
The canonical SMILES for 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine is CC(C)(CNCCC1COCCN1)c1ccncc1.
What is the InChIKey of 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine?
The InChIKey is JACWKQXKSOTHEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-15(2,13-3-6-16-7-4-13)12-17-8-5-14-11-19-10-9-18-14/h3-4,6-7,14,17-18H,5,8-12H2,1-2H3.
What are the key properties of 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine?
2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 1.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-morpholin-3-ylethyl)-2-pyridin-4-ylpropan-1-amine is sourced from PubChem (CID 115239068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).