1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine

C14H23N3O — CID 80634198

IUPAC1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine
SMILESCC(N)Cc1ccc(N2CC(C)OCC2C)nc1
InChIInChI=1S/C14H23N3O/c1-10(15)6-13-4-5-14(16-7-13)17-8-12(3)18-9-11(17)2/h4-5,7,10-12H,6,8-9,15H2,1-3H3
InChIKeyAMSQIDZFQXOPER-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.58
Rot. Bonds3

About 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine

1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine (PubChem CID 80634198) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine.

Molecular Properties

Compound Name1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine
PubChem CID80634198
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine
SMILESCC(N)Cc1ccc(N2CC(C)OCC2C)nc1
InChIInChI=1S/C14H23N3O/c1-10(15)6-13-4-5-14(16-7-13)17-8-12(3)18-9-11(17)2/h4-5,7,10-12H,6,8-9,15H2,1-3H3
InChIKeyAMSQIDZFQXOPER-UHFFFAOYSA-N
XLogP1.58
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine?
The IUPAC name of 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine (CID 80634198) is 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine.
What is the SMILES notation for 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine?
The canonical SMILES for 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine is CC(N)Cc1ccc(N2CC(C)OCC2C)nc1.
What is the InChIKey of 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine?
The InChIKey is AMSQIDZFQXOPER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-10(15)6-13-4-5-14(16-7-13)17-8-12(3)18-9-11(17)2/h4-5,7,10-12H,6,8-9,15H2,1-3H3.
What are the key properties of 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine?
1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine has a molecular weight of 249.36 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2,5-dimethylmorpholin-4-yl)-3-pyridinyl]propan-2-amine is sourced from PubChem (CID 80634198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).