(2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine

C15H16FN5O — CID 177329280

IUPAC(2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine
SMILESFc1ccc([C@H]2CN(C3=CN4NNN=C4C=C3)CCO2)cc1
InChIInChI=1S/C15H16FN5O/c16-12-3-1-11(2-4-12)14-10-20(7-8-22-14)13-5-6-15-17-18-19-21(15)9-13/h1-6,9,14,18-19H,7-8,10H2/t14-/m1/s1
InChIKeyUBTRPZSAXKTYIY-CQSZACIVSA-N
MW301.33 g/mol
LogP1.25
Rot. Bonds2

About (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine

(2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine (PubChem CID 177329280) has the molecular formula C15H16FN5O and a molecular weight of 301.33 g/mol. Its IUPAC name is (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine.

Molecular Properties

Compound Name(2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine
PubChem CID177329280
Molecular FormulaC15H16FN5O
Molecular Weight301.33 g/mol
Exact Mass301.13
IUPAC Name(2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine
SMILESFc1ccc([C@H]2CN(C3=CN4NNN=C4C=C3)CCO2)cc1
InChIInChI=1S/C15H16FN5O/c16-12-3-1-11(2-4-12)14-10-20(7-8-22-14)13-5-6-15-17-18-19-21(15)9-13/h1-6,9,14,18-19H,7-8,10H2/t14-/m1/s1
InChIKeyUBTRPZSAXKTYIY-CQSZACIVSA-N
XLogP1.25
TPSA52.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.33
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(2R)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-methyl-1,3-thiazol-2-yl)morpholine;hydroiodide
CID 177329076
(2R)-2-(4-fluorophenyl)-4-methylmorpholine
CID 67355003
(2R)-4-(4,5-dihydro-1H-imidazol-2-yl)-2-[4-(4-fluorophenyl)phenyl]morpholine
CID 155405578
4-(5,6-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-2-(4-fluorophenyl)morpholine
CID 163312558
(2S)-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-(4-fluorophenyl)morpholine
CID 36726620
(2R)-2-(4-fluorophenyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)morpholine
CID 95557093
(2R)-4-tert-butyl-2-(4-fluorophenyl)morpholine
CID 67354572
2-(4-fluorophenyl)-4-[5-(methylsulfonylmethyl)-2-pyridinyl]morpholine
CID 56875710
4-[5,6-dimethyl-2-(trifluoromethyl)pyrimidin-4-yl]-2-(4-fluorophenyl)morpholine
CID 56877170
(2R)-2-(4-fluorophenyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)morpholine
CID 94180497
4-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-2-methoxypyridine-3-carbonitrile
CID 95455764
2-(4-chlorophenyl)-4-[5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]morpholine
CID 133456570

Frequently Asked Questions

What is the IUPAC name of (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine?
The IUPAC name of (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine (CID 177329280) is (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine.
What is the SMILES notation for (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine?
The canonical SMILES for (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine is Fc1ccc([C@H]2CN(C3=CN4NNN=C4C=C3)CCO2)cc1.
What is the InChIKey of (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine?
The InChIKey is UBTRPZSAXKTYIY-CQSZACIVSA-N. The full InChI is InChI=1S/C15H16FN5O/c16-12-3-1-11(2-4-12)14-10-20(7-8-22-14)13-5-6-15-17-18-19-21(15)9-13/h1-6,9,14,18-19H,7-8,10H2/t14-/m1/s1.
What are the key properties of (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine?
(2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine has a molecular weight of 301.33 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-(2,3-dihydrotetrazolo[1,5-a]pyridin-6-yl)-2-(4-fluorophenyl)morpholine is sourced from PubChem (CID 177329280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).