1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol

C15H22FNO2 — CID 55099454

IUPAC1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol
SMILESCN(CCC(O)c1ccc(F)cc1)CC1CCCO1
InChIInChI=1S/C15H22FNO2/c1-17(11-14-3-2-10-19-14)9-8-15(18)12-4-6-13(16)7-5-12/h4-7,14-15,18H,2-3,8-11H2,1H3
InChIKeyQVMAADZMBJVKFO-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.36
Rot. Bonds6

About 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol

1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol (PubChem CID 55099454) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol
PubChem CID55099454
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol
SMILESCN(CCC(O)c1ccc(F)cc1)CC1CCCO1
InChIInChI=1S/C15H22FNO2/c1-17(11-14-3-2-10-19-14)9-8-15(18)12-4-6-13(16)7-5-12/h4-7,14-15,18H,2-3,8-11H2,1H3
InChIKeyQVMAADZMBJVKFO-UHFFFAOYSA-N
XLogP2.36
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-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

1-(4-fluorophenyl)-N'-methyl-N'-(oxolan-2-ylmethyl)propane-1,3-diamine
CID 62642970
3-[methyl(oxan-2-ylmethyl)amino]-1-phenylpropan-1-ol
CID 62613757
(1S)-2-[cyclopropyl-[[(2R)-oxolan-2-yl]methyl]amino]-1-(4-fluorophenyl)ethanol
CID 129424046
3-[methyl(oxan-2-ylmethyl)amino]-1-(2-methylphenyl)propan-1-ol
CID 62624909
1-(2,5-difluorophenyl)-2-[methyl(oxolan-2-ylmethyl)amino]ethanol
CID 110898634
1-amino-4-[methyl(oxolan-2-ylmethyl)amino]butan-2-ol
CID 64820238
3-[cyclohexyl(methyl)amino]-1-(4-fluorophenyl)propan-1-ol
CID 62643359
1-(4-fluorophenyl)-2-[methyl(oxan-2-ylmethyl)amino]ethanone
CID 61432503
1-(4-chlorophenyl)-3-[cyclopropylmethyl(methyl)amino]propan-1-ol
CID 62628773
1-(4-methylphenyl)-2-(oxolan-2-yl)ethanol
CID 60797370
1-(3,5-dimethylphenyl)-2-[methyl(oxolan-2-ylmethyl)amino]ethanol
CID 79039900
2-(4-fluorophenyl)-3-(oxolan-2-yl)propan-1-ol
CID 79438066

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol?
The IUPAC name of 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol (CID 55099454) is 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol.
What is the SMILES notation for 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol?
The canonical SMILES for 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol is CN(CCC(O)c1ccc(F)cc1)CC1CCCO1.
What is the InChIKey of 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol?
The InChIKey is QVMAADZMBJVKFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-17(11-14-3-2-10-19-14)9-8-15(18)12-4-6-13(16)7-5-12/h4-7,14-15,18H,2-3,8-11H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol?
1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol has a molecular weight of 267.34 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-[methyl(oxolan-2-ylmethyl)amino]propan-1-ol is sourced from PubChem (CID 55099454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).