[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol

C9H17F3N2O2 — CID 103366472

IUPAC[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol
SMILESNCC(CN1CCOCC1CO)C(F)(F)F
InChIInChI=1S/C9H17F3N2O2/c10-9(11,12)7(3-13)4-14-1-2-16-6-8(14)5-15/h7-8,15H,1-6,13H2
InChIKeyONMAWQJJCVURQI-UHFFFAOYSA-N
MW242.24 g/mol
LogP-0.18
Rot. Bonds4

About [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol

[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol (PubChem CID 103366472) has the molecular formula C9H17F3N2O2 and a molecular weight of 242.24 g/mol. Its IUPAC name is [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol.

Molecular Properties

Compound Name[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol
PubChem CID103366472
Molecular FormulaC9H17F3N2O2
Molecular Weight242.24 g/mol
Exact Mass242.12
IUPAC Name[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol
SMILESNCC(CN1CCOCC1CO)C(F)(F)F
InChIInChI=1S/C9H17F3N2O2/c10-9(11,12)7(3-13)4-14-1-2-16-6-8(14)5-15/h7-8,15H,1-6,13H2
InChIKeyONMAWQJJCVURQI-UHFFFAOYSA-N
XLogP-0.18
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.24
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol with MolForge

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Related Compounds

3,3,3-Trifluoro-2-[(3-methylmorpholin-4-yl)methyl]propan-1-amine
CID 103366144
2-[(3-Ethylmorpholin-4-yl)methyl]-3,3,3-trifluoropropan-1-amine
CID 103366177
3,3,3-Trifluoro-2-[[3-(hydroxymethyl)morpholin-4-yl]methyl]propanethioamide
CID 103368836
3,3,3-Trifluoro-2-[[3-(hydroxymethyl)morpholin-4-yl]methyl]propanimidamide
CID 103370834
1,1,1-Trifluoro-3-[(4-propan-2-ylmorpholin-2-yl)methylamino]propan-2-ol
CID 105644937
1-Morpholin-4-yl-3-(4,4,4-trifluorobutan-2-ylamino)propan-2-ol
CID 105935709
2,2-Difluoro-3-[(4-propan-2-ylmorpholin-2-yl)methylamino]propan-1-ol
CID 106176565
3-Methoxy-2-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]propan-1-ol
CID 108412461
2-Methyl-1-morpholin-4-yl-3-(4,4,4-trifluorobutan-2-ylamino)propan-2-ol
CID 112328206
[4-[2-(Aminomethyl)-3,3,3-trifluoropropyl]-5-methylmorpholin-2-yl]methanol
CID 113807385
1,1-Difluoro-3-[(4-propan-2-ylmorpholin-2-yl)methylamino]propan-2-ol
CID 114093466
3-[2-(1-Aminoethyl)morpholin-4-yl]-1,1,1-trifluoropropan-2-ol
CID 115315417

Frequently Asked Questions

What is the IUPAC name of [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol?
The IUPAC name of [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol (CID 103366472) is [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol.
What is the SMILES notation for [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol?
The canonical SMILES for [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol is NCC(CN1CCOCC1CO)C(F)(F)F.
What is the InChIKey of [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol?
The InChIKey is ONMAWQJJCVURQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3N2O2/c10-9(11,12)7(3-13)4-14-1-2-16-6-8(14)5-15/h7-8,15H,1-6,13H2.
What are the key properties of [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol?
[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol has a molecular weight of 242.24 g/mol, XLogP of -0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]morpholin-3-yl]methanol is sourced from PubChem (CID 103366472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).