2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol

C15H22FNO2 — CID 117422004

IUPAC2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol
SMILESCC(C)(CO)c1ccc(CN2CCOCC2)c(F)c1
InChIInChI=1S/C15H22FNO2/c1-15(2,11-18)13-4-3-12(14(16)9-13)10-17-5-7-19-8-6-17/h3-4,9,18H,5-8,10-11H2,1-2H3
InChIKeyPBLBRRYQGIJOHZ-UHFFFAOYSA-N
MW267.34 g/mol
LogP1.93
Rot. Bonds4

About 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol

2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol (PubChem CID 117422004) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol
PubChem CID117422004
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol
SMILESCC(C)(CO)c1ccc(CN2CCOCC2)c(F)c1
InChIInChI=1S/C15H22FNO2/c1-15(2,11-18)13-4-3-12(14(16)9-13)10-17-5-7-19-8-6-17/h3-4,9,18H,5-8,10-11H2,1-2H3
InChIKeyPBLBRRYQGIJOHZ-UHFFFAOYSA-N
XLogP1.93
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]propanoic acid
CID 117421534
ethyl 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-oxoacetate
CID 117475900
[1-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]cyclopropyl]methanamine
CID 117415603
4-[(4-chloro-2,5-difluorophenyl)methyl]morpholine
CID 59543863
4-[(3-fluoro-5-iodo-2-methylphenyl)methyl]morpholine
CID 146419337
5-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 168598045
tert-butyl 4-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxylate
CID 118378621
4-amino-4-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]butanoic acid
CID 117477615
2-[1-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]pyrrolidin-3-yl]propan-2-ol
CID 131932947
5-amino-2-(morpholin-4-ylmethyl)phenol
CID 19799808
3-[3-fluoro-4-(1,4-oxazepan-4-ylmethyl)phenyl]prop-2-enoic acid
CID 76979620
2-[4-(morpholin-4-ylmethyl)phenyl]propan-2-amine
CID 82026958

Frequently Asked Questions

What is the IUPAC name of 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol?
The IUPAC name of 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol (CID 117422004) is 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol?
The canonical SMILES for 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol is CC(C)(CO)c1ccc(CN2CCOCC2)c(F)c1.
What is the InChIKey of 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol?
The InChIKey is PBLBRRYQGIJOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-15(2,11-18)13-4-3-12(14(16)9-13)10-17-5-7-19-8-6-17/h3-4,9,18H,5-8,10-11H2,1-2H3.
What are the key properties of 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol?
2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol has a molecular weight of 267.34 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-2-methylpropan-1-ol is sourced from PubChem (CID 117422004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).