[4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol

C14H23N3O2 — CID 104969843

IUPAC[4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
SMILESC[C@H](N)c1ccc(N2CC(CO)OC(C)(C)C2)cn1
InChIInChI=1S/C14H23N3O2/c1-10(15)13-5-4-11(6-16-13)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
InChIKeyKGYFUJWAOFMRGD-NUHJPDEHSA-N
MW265.36 g/mol
LogP1.08
Rot. Bonds3

About [4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol

[4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol (PubChem CID 104969843) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is [4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
PubChem CID104969843
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name[4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
SMILESC[C@H](N)c1ccc(N2CC(CO)OC(C)(C)C2)cn1
InChIInChI=1S/C14H23N3O2/c1-10(15)13-5-4-11(6-16-13)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
InChIKeyKGYFUJWAOFMRGD-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

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Related Compounds

2-(1-aminoethyl)-5-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]phenol
CID 114777220
[6,6-dimethyl-4-(6-nitro-3-pyridinyl)morpholin-2-yl]methanol
CID 114779409
[4-[4-[(1S)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 104969852
[4-[4-[(1R)-1-aminoethyl]-2-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 104969828
[4-(6-amino-5-propan-2-ylpyrimidin-4-yl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114782706
4-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]benzonitrile
CID 114776853
(1R)-1-[5-(2-ethyl-1,4-oxazepan-4-yl)-2-pyridinyl]ethanamine
CID 114218474
1-[6-(1-aminoethyl)-3-pyridinyl]piperidin-4-ol
CID 83122211
1-[6-[(1S)-1-aminoethyl]-3-pyridinyl]piperidin-3-ol
CID 83122329
4-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-methylbenzaldehyde
CID 114777267
1-[5-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-pyridinyl]ethanamine
CID 83127327
(1R)-1-[5-(azepan-1-yl)-2-pyridinyl]ethanamine
CID 83123042

Frequently Asked Questions

What is the IUPAC name of [4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol?
The IUPAC name of [4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol (CID 104969843) is [4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol is C[C@H](N)c1ccc(N2CC(CO)OC(C)(C)C2)cn1.
What is the InChIKey of [4-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol?
The InChIKey is KGYFUJWAOFMRGD-NUHJPDEHSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10(15)13-5-4-11(6-16-13)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-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol?
[4-[6-[(1S)-1-aminoethyl]-3-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-[6-[(1S)-1-aminoethyl]-3-pyridinyl]-6,6-dimethylmorpholin-2-yl]methanol is sourced from PubChem (CID 104969843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).