[6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine

C13H21N3O — CID 102938911

IUPAC[6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine
SMILESCC1CN(CCc2cccnc2)CC(CN)O1
InChIInChI=1S/C13H21N3O/c1-11-9-16(10-13(7-14)17-11)6-4-12-3-2-5-15-8-12/h2-3,5,8,11,13H,4,6-7,9-10,14H2,1H3
InChIKeyUEGBXAXDPZTJJJ-UHFFFAOYSA-N
MW235.33 g/mol
LogP0.67
Rot. Bonds4

About [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine

[6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine (PubChem CID 102938911) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine
PubChem CID102938911
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name[6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine
SMILESCC1CN(CCc2cccnc2)CC(CN)O1
InChIInChI=1S/C13H21N3O/c1-11-9-16(10-13(7-14)17-11)6-4-12-3-2-5-15-8-12/h2-3,5,8,11,13H,4,6-7,9-10,14H2,1H3
InChIKeyUEGBXAXDPZTJJJ-UHFFFAOYSA-N
XLogP0.67
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine?
The IUPAC name of [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine (CID 102938911) is [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine.
What is the SMILES notation for [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine?
The canonical SMILES for [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine is CC1CN(CCc2cccnc2)CC(CN)O1.
What is the InChIKey of [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine?
The InChIKey is UEGBXAXDPZTJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-11-9-16(10-13(7-14)17-11)6-4-12-3-2-5-15-8-12/h2-3,5,8,11,13H,4,6-7,9-10,14H2,1H3.
What are the key properties of [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine?
[6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine has a molecular weight of 235.33 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-4-(2-pyridin-3-ylethyl)morpholin-2-yl]methanamine is sourced from PubChem (CID 102938911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).