[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol

C10H19F3N2O2 — CID 103366491

IUPAC[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(CC(CN)C(F)(F)F)CC(CO)O1
InChIInChI=1S/C10H19F3N2O2/c1-7-3-15(5-9(6-16)17-7)4-8(2-14)10(11,12)13/h7-9,16H,2-6,14H2,1H3
InChIKeyDNKRJIGYOYSHCX-UHFFFAOYSA-N
MW256.27 g/mol
LogP0.21
Rot. Bonds4

About [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol

[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol (PubChem CID 103366491) has the molecular formula C10H19F3N2O2 and a molecular weight of 256.27 g/mol. Its IUPAC name is [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol
PubChem CID103366491
Molecular FormulaC10H19F3N2O2
Molecular Weight256.27 g/mol
Exact Mass256.14
IUPAC Name[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(CC(CN)C(F)(F)F)CC(CO)O1
InChIInChI=1S/C10H19F3N2O2/c1-7-3-15(5-9(6-16)17-7)4-8(2-14)10(11,12)13/h7-9,16H,2-6,14H2,1H3
InChIKeyDNKRJIGYOYSHCX-UHFFFAOYSA-N
XLogP0.21
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol (CID 103366491) is [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol is CC1CN(CC(CN)C(F)(F)F)CC(CO)O1.
What is the InChIKey of [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol?
The InChIKey is DNKRJIGYOYSHCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O2/c1-7-3-15(5-9(6-16)17-7)4-8(2-14)10(11,12)13/h7-9,16H,2-6,14H2,1H3.
What are the key properties of [4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol?
[4-[2-(aminomethyl)-3,3,3-trifluoropropyl]-6-methylmorpholin-2-yl]methanol has a molecular weight of 256.27 g/mol, XLogP of 0.21, 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]-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 103366491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).