1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine

C11H11FN2O — CID 3049275

IUPAC1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine
SMILESCNCc1ncc(-c2ccc(F)cc2)o1
InChIInChI=1S/C11H11FN2O/c1-13-7-11-14-6-10(15-11)8-2-4-9(12)5-3-8/h2-6,13H,7H2,1H3
InChIKeyQPYKFYCGBJIASF-UHFFFAOYSA-N
MW206.22 g/mol
LogP2.20
Rot. Bonds3

About 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine

1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine (PubChem CID 3049275) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine
PubChem CID3049275
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine
SMILESCNCc1ncc(-c2ccc(F)cc2)o1
InChIInChI=1S/C11H11FN2O/c1-13-7-11-14-6-10(15-11)8-2-4-9(12)5-3-8/h2-6,13H,7H2,1H3
InChIKeyQPYKFYCGBJIASF-UHFFFAOYSA-N
XLogP2.20
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylethanamine
CID 65182883
1-[5-(3-chloro-4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine
CID 82879726
1-[5-(4-chloro-3-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine
CID 107994677
N-methyl-1-[5-(2,3,4,5,6-pentafluorophenyl)-1,3-oxazol-2-yl]methanamine
CID 65179268
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]acetonitrile
CID 82397195
(1R)-1-(4-chlorophenyl)-N-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl]ethanamine
CID 8636383
N-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl]-2-(4-methyl-1,3-thiazol-2-yl)propan-2-amine
CID 71869006
1-[5-(6-bromonaphthalen-2-yl)-1,3-oxazol-2-yl]-N-methylmethanamine
CID 115354582
1-[5-(3-iodophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine
CID 65178557
1-[5-(3,5-dimethoxyphenyl)-1,3-oxazol-2-yl]-N-methylmethanamine
CID 65179211
N-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine
CID 65185138
N-[[5-(3-fluorophenyl)-1,3-oxazol-2-yl]methyl]ethanamine
CID 54516373

Frequently Asked Questions

What is the IUPAC name of 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine (CID 3049275) is 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine is CNCc1ncc(-c2ccc(F)cc2)o1.
What is the InChIKey of 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine?
The InChIKey is QPYKFYCGBJIASF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-13-7-11-14-6-10(15-11)8-2-4-9(12)5-3-8/h2-6,13H,7H2,1H3.
What are the key properties of 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine?
1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine has a molecular weight of 206.22 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylmethanamine is sourced from PubChem (CID 3049275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).