[4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine

C11H17N3O — CID 81246555

IUPAC[4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine
SMILESCC1COCCN1c1ccncc1CN
InChIInChI=1S/C11H17N3O/c1-9-8-15-5-4-14(9)11-2-3-13-7-10(11)6-12/h2-3,7,9H,4-6,8,12H2,1H3
InChIKeyWUVJVBQEJPPDJX-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.77
Rot. Bonds2

About [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine

[4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine (PubChem CID 81246555) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine
PubChem CID81246555
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name[4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine
SMILESCC1COCCN1c1ccncc1CN
InChIInChI=1S/C11H17N3O/c1-9-8-15-5-4-14(9)11-2-3-13-7-10(11)6-12/h2-3,7,9H,4-6,8,12H2,1H3
InChIKeyWUVJVBQEJPPDJX-UHFFFAOYSA-N
XLogP0.77
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(2-methylpyrrolidin-1-yl)-3-pyridinyl]methanamine
CID 81249026
[4-[(2R)-2-methylpiperidin-1-yl]-3-pyridinyl]methanamine
CID 97053137
(3R)-3-methyl-4-[3-(2-phenylimidazol-1-yl)-4-pyridinyl]morpholine
CID 175322187
[3-(3-methylmorpholin-4-yl)phenyl]methanamine
CID 102813467
azane;3-methyl-4-pyrimidin-4-ylmorpholine
CID 175987866
N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]ethanamine
CID 43542427
N-[[2-(3-methylmorpholin-4-yl)phenyl]methyl]propan-2-amine
CID 43542425
2-(4-morpholin-4-yl-3-pyridinyl)ethanamine
CID 83883289
4-[6-(chloromethyl)pyrazin-2-yl]-3-methylmorpholine
CID 66467326
3-methyl-4-[(3S)-3-methylmorpholin-4-yl]aniline
CID 93111224
4-imidazol-1-yl-6-(3-methylmorpholin-4-yl)-1,3,5-triazin-2-amine
CID 80781643
N-[[5-(3-methylmorpholin-4-yl)pyrazin-2-yl]methyl]propan-2-amine
CID 107379181

Frequently Asked Questions

What is the IUPAC name of [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine?
The IUPAC name of [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine (CID 81246555) is [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine?
The canonical SMILES for [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine is CC1COCCN1c1ccncc1CN.
What is the InChIKey of [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine?
The InChIKey is WUVJVBQEJPPDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-9-8-15-5-4-14(9)11-2-3-13-7-10(11)6-12/h2-3,7,9H,4-6,8,12H2,1H3.
What are the key properties of [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine?
[4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine has a molecular weight of 207.28 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methylmorpholin-4-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 81246555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).