[4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol

C14H23N3O2 — CID 104969852

IUPAC[4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
SMILESC[C@H](N)c1ccnc(N2CC(CO)OC(C)(C)C2)c1
InChIInChI=1S/C14H23N3O2/c1-10(15)11-4-5-16-13(6-11)17-7-12(8-18)19-14(2,3)9-17/h4-6,10,12,18H,7-9,15H2,1-3H3/t10-,12?/m0/s1
InChIKeyVJHPZNYPWUMJHR-NUHJPDEHSA-N
MW265.36 g/mol
LogP1.08
Rot. Bonds3

About [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol

[4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol (PubChem CID 104969852) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
PubChem CID104969852
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name[4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
SMILESC[C@H](N)c1ccnc(N2CC(CO)OC(C)(C)C2)c1
InChIInChI=1S/C14H23N3O2/c1-10(15)11-4-5-16-13(6-11)17-7-12(8-18)19-14(2,3)9-17/h4-6,10,12,18H,7-9,15H2,1-3H3/t10-,12?/m0/s1
InChIKeyVJHPZNYPWUMJHR-NUHJPDEHSA-N
XLogP1.08
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol with MolForge

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Related Compounds

[4-[4-[(1R)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 104969828
[4-[4-[(1R)-1-aminoethyl]-2-pyridinyl]morpholin-2-yl]methanol
CID 81205057
(1R)-1-[2-(2,2,6,6-tetramethylmorpholin-4-yl)-4-pyridinyl]ethanamine
CID 102744222
[4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 104969843
2-(1-aminoethyl)-5-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]phenol
CID 114777220
[4-(6-amino-5-propan-2-ylpyrimidin-4-yl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114782706
[6,6-dimethyl-4-(1-methylimidazol-2-yl)morpholin-2-yl]methanol
CID 114779352
6-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]pyridine-3-carbaldehyde
CID 114777262
[4-(4-amino-6-chloro-2-pyridinyl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114070637
[4-(6-aminoquinolin-2-yl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114776187
1-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-3-methylpiperidin-3-ol
CID 104876735
1-[4-[(1R)-1-aminoethyl]-2-pyridinyl]-3-methylpiperidin-3-ol
CID 104876717

Frequently Asked Questions

What is the IUPAC name of [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol?
The IUPAC name of [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol (CID 104969852) is [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol is C[C@H](N)c1ccnc(N2CC(CO)OC(C)(C)C2)c1.
What is the InChIKey of [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol?
The InChIKey is VJHPZNYPWUMJHR-NUHJPDEHSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10(15)11-4-5-16-13(6-11)17-7-12(8-18)19-14(2,3)9-17/h4-6,10,12,18H,7-9,15H2,1-3H3/t10-,12?/m0/s1.
What are the key properties of [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol?
[4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol has a molecular weight of 265.36 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol is sourced from PubChem (CID 104969852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).