4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine

C11H12FN5O — CID 124518132

IUPAC4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine
SMILESFc1cccc(N2CCOCC2)c1-c1nn[nH]n1
InChIInChI=1S/C11H12FN5O/c12-8-2-1-3-9(17-4-6-18-7-5-17)10(8)11-13-15-16-14-11/h1-3H,4-7H2,(H,13,14,15,16)
InChIKeyPCCJCWPDWCLDJF-UHFFFAOYSA-N
MW249.25 g/mol
LogP0.84
Rot. Bonds2

About 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine

4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine (PubChem CID 124518132) has the molecular formula C11H12FN5O and a molecular weight of 249.25 g/mol. Its IUPAC name is 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine.

Molecular Properties

Compound Name4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine
PubChem CID124518132
Molecular FormulaC11H12FN5O
Molecular Weight249.25 g/mol
Exact Mass249.10
IUPAC Name4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine
SMILESFc1cccc(N2CCOCC2)c1-c1nn[nH]n1
InChIInChI=1S/C11H12FN5O/c12-8-2-1-3-9(17-4-6-18-7-5-17)10(8)11-13-15-16-14-11/h1-3H,4-7H2,(H,13,14,15,16)
InChIKeyPCCJCWPDWCLDJF-UHFFFAOYSA-N
XLogP0.84
TPSA66.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.25
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine 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

4-[4-(2H-tetrazol-5-yl)phenyl]morpholine
CID 863212
2-fluoro-6-morpholin-4-ylphenol
CID 46737228
4-(3-fluoro-2-nitrophenyl)morpholine
CID 53255500
2-[2-fluoro-6-(1,4-oxazepan-4-yl)phenyl]ethanamine
CID 114065996
4-(2,6-difluorophenyl)morpholine;ethane
CID 156637338
morpholin-4-yl-[4-(2H-tetrazol-5-yl)phenyl]methanone
CID 32686320
4-[3-chloro-2-(chloromethyl)phenyl]morpholine
CID 28946203
N-(6-fluoro-7-morpholin-4-yl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-4-(2H-tetrazol-5-yl)benzamide
CID 167025836
1-[2-fluoro-6-(1,4-oxazepan-4-yl)phenyl]ethanamine
CID 62974495
4-(2-chloro-3-methoxyphenyl)morpholine
CID 102440572
4-(3-fluoro-4-pyridinyl)morpholine
CID 91005494
3-[5-(2,6-difluorophenyl)-1,3-oxazol-2-yl]-N-methyl-N-[(2-morpholin-4-ylphenyl)methyl]propanamide
CID 29481269

Frequently Asked Questions

What is the IUPAC name of 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine?
The IUPAC name of 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine (CID 124518132) is 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine.
What is the SMILES notation for 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine?
The canonical SMILES for 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine is Fc1cccc(N2CCOCC2)c1-c1nn[nH]n1.
What is the InChIKey of 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine?
The InChIKey is PCCJCWPDWCLDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN5O/c12-8-2-1-3-9(17-4-6-18-7-5-17)10(8)11-13-15-16-14-11/h1-3H,4-7H2,(H,13,14,15,16).
What are the key properties of 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine?
4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine has a molecular weight of 249.25 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-fluoro-2-(2H-tetrazol-5-yl)phenyl]morpholine is sourced from PubChem (CID 124518132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).