N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine

C14H16FN3OS — CID 53272281

IUPACN-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine
SMILESFc1ccccc1-c1cnc(CNN2CCOCC2)s1
InChIInChI=1S/C14H16FN3OS/c15-12-4-2-1-3-11(12)13-9-16-14(20-13)10-17-18-5-7-19-8-6-18/h1-4,9,17H,5-8,10H2
InChIKeyUCFJIFJODQKVNA-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.29
Rot. Bonds4

About N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine

N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine (PubChem CID 53272281) has the molecular formula C14H16FN3OS and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine.

Molecular Properties

Compound NameN-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine
PubChem CID53272281
Molecular FormulaC14H16FN3OS
Molecular Weight293.37 g/mol
Exact Mass293.10
IUPAC NameN-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine
SMILESFc1ccccc1-c1cnc(CNN2CCOCC2)s1
InChIInChI=1S/C14H16FN3OS/c15-12-4-2-1-3-11(12)13-9-16-14(20-13)10-17-18-5-7-19-8-6-18/h1-4,9,17H,5-8,10H2
InChIKeyUCFJIFJODQKVNA-UHFFFAOYSA-N
XLogP2.29
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine?
The IUPAC name of N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine (CID 53272281) is N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine.
What is the SMILES notation for N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine?
The canonical SMILES for N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine is Fc1ccccc1-c1cnc(CNN2CCOCC2)s1.
What is the InChIKey of N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine?
The InChIKey is UCFJIFJODQKVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3OS/c15-12-4-2-1-3-11(12)13-9-16-14(20-13)10-17-18-5-7-19-8-6-18/h1-4,9,17H,5-8,10H2.
What are the key properties of N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine?
N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine has a molecular weight of 293.37 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]morpholin-4-amine is sourced from PubChem (CID 53272281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).