1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine

C20H19F2N3O — CID 75411347

IUPAC1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine
SMILESFc1ccc(CNC[C@H]2Cn3c(-c4ccc(F)cc4)cnc3CO2)cc1
InChIInChI=1S/C20H19F2N3O/c21-16-5-1-14(2-6-16)9-23-10-18-12-25-19(11-24-20(25)13-26-18)15-3-7-17(22)8-4-15/h1-8,11,18,23H,9-10,12-13H2/t18-/m0/s1
InChIKeyMGOJRXOAMQLTCR-SFHVURJKSA-N
MW355.39 g/mol
LogP3.52
Rot. Bonds5

About 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine

1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine (PubChem CID 75411347) has the molecular formula C20H19F2N3O and a molecular weight of 355.39 g/mol. Its IUPAC name is 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine.

Molecular Properties

Compound Name1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine
PubChem CID75411347
Molecular FormulaC20H19F2N3O
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC Name1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine
SMILESFc1ccc(CNC[C@H]2Cn3c(-c4ccc(F)cc4)cnc3CO2)cc1
InChIInChI=1S/C20H19F2N3O/c21-16-5-1-14(2-6-16)9-23-10-18-12-25-19(11-24-20(25)13-26-18)15-3-7-17(22)8-4-15/h1-8,11,18,23H,9-10,12-13H2/t18-/m0/s1
InChIKeyMGOJRXOAMQLTCR-SFHVURJKSA-N
XLogP3.52
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine 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 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine?
The IUPAC name of 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine (CID 75411347) is 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine.
What is the SMILES notation for 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine?
The canonical SMILES for 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine is Fc1ccc(CNC[C@H]2Cn3c(-c4ccc(F)cc4)cnc3CO2)cc1.
What is the InChIKey of 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine?
The InChIKey is MGOJRXOAMQLTCR-SFHVURJKSA-N. The full InChI is InChI=1S/C20H19F2N3O/c21-16-5-1-14(2-6-16)9-23-10-18-12-25-19(11-24-20(25)13-26-18)15-3-7-17(22)8-4-15/h1-8,11,18,23H,9-10,12-13H2/t18-/m0/s1.
What are the key properties of 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine?
1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine has a molecular weight of 355.39 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6S)-3-(4-fluorophenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]-N-[(4-fluorophenyl)methyl]methanamine is sourced from PubChem (CID 75411347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).