3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine

C12H19N3O — CID 62471712

IUPAC3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine
SMILESCC1CN(Cc2cccnc2N)C(C)CO1
InChIInChI=1S/C12H19N3O/c1-9-8-16-10(2)6-15(9)7-11-4-3-5-14-12(11)13/h3-5,9-10H,6-8H2,1-2H3,(H2,13,14)
InChIKeyFWXWHZGSCRLIMG-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.27
Rot. Bonds2

About 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine

3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine (PubChem CID 62471712) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine
PubChem CID62471712
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine
SMILESCC1CN(Cc2cccnc2N)C(C)CO1
InChIInChI=1S/C12H19N3O/c1-9-8-16-10(2)6-15(9)7-11-4-3-5-14-12(11)13/h3-5,9-10H,6-8H2,1-2H3,(H2,13,14)
InChIKeyFWXWHZGSCRLIMG-UHFFFAOYSA-N
XLogP1.27
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine (CID 62471712) is 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine is CC1CN(Cc2cccnc2N)C(C)CO1.
What is the InChIKey of 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine?
The InChIKey is FWXWHZGSCRLIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-8-16-10(2)6-15(9)7-11-4-3-5-14-12(11)13/h3-5,9-10H,6-8H2,1-2H3,(H2,13,14).
What are the key properties of 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine?
3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine has a molecular weight of 221.30 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,5-dimethylmorpholin-4-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 62471712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).