(3S)-3-(5H-tetrazol-5-yl)morpholine

C5H9N5O — CID 129389237

IUPAC(3S)-3-(5H-tetrazol-5-yl)morpholine
SMILESC1COC[C@H](C2N=NN=N2)N1
InChIInChI=1S/C5H9N5O/c1-2-11-3-4(6-1)5-7-9-10-8-5/h4-6H,1-3H2/t4-/m1/s1
InChIKeyLSOSXYFDBBNNHQ-SCSAIBSYSA-N
MW155.16 g/mol
LogP0.13
Rot. Bonds1

About (3S)-3-(5H-tetrazol-5-yl)morpholine

(3S)-3-(5H-tetrazol-5-yl)morpholine (PubChem CID 129389237) has the molecular formula C5H9N5O and a molecular weight of 155.16 g/mol. Its IUPAC name is (3S)-3-(5H-tetrazol-5-yl)morpholine.

Molecular Properties

Compound Name(3S)-3-(5H-tetrazol-5-yl)morpholine
PubChem CID129389237
Molecular FormulaC5H9N5O
Molecular Weight155.16 g/mol
Exact Mass155.08
IUPAC Name(3S)-3-(5H-tetrazol-5-yl)morpholine
SMILESC1COC[C@H](C2N=NN=N2)N1
InChIInChI=1S/C5H9N5O/c1-2-11-3-4(6-1)5-7-9-10-8-5/h4-6H,1-3H2/t4-/m1/s1
InChIKeyLSOSXYFDBBNNHQ-SCSAIBSYSA-N
XLogP0.13
TPSA70.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(3S)-3-[(3S)-morpholin-3-yl]morpholine
CID 11693975
3-cyclohexylmorpholine
CID 54373245
2-(5H-tetrazol-5-yl)-1,3-oxazolidine
CID 175563681
3-(2,3-dihydropyridin-2-yl)morpholine
CID 91173291
(3-morpholin-3-ylcyclopentyl)azanium
CID 163746361
trans-(1R,2S)-2-[(3S)-morpholin-3-yl]cyclopentan-1-ol
CID 124709951
3-(1-methylpiperidin-3-yl)morpholine
CID 82406439
3-(bromomethyl)morpholine
CID 70577689
1,2,3,3a,4,5,7,7a-octahydropyrano[3,4-b]pyrrole
CID 68902591
3-(6-azaspiro[2.5]octan-8-yl)morpholine
CID 167222320
3-[4-(trifluoromethyl)cyclohexyl]morpholine
CID 149088087
(3S)-3-iodomorpholine
CID 89004392

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(5H-tetrazol-5-yl)morpholine?
The IUPAC name of (3S)-3-(5H-tetrazol-5-yl)morpholine (CID 129389237) is (3S)-3-(5H-tetrazol-5-yl)morpholine.
What is the SMILES notation for (3S)-3-(5H-tetrazol-5-yl)morpholine?
The canonical SMILES for (3S)-3-(5H-tetrazol-5-yl)morpholine is C1COC[C@H](C2N=NN=N2)N1.
What is the InChIKey of (3S)-3-(5H-tetrazol-5-yl)morpholine?
The InChIKey is LSOSXYFDBBNNHQ-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H9N5O/c1-2-11-3-4(6-1)5-7-9-10-8-5/h4-6H,1-3H2/t4-/m1/s1.
What are the key properties of (3S)-3-(5H-tetrazol-5-yl)morpholine?
(3S)-3-(5H-tetrazol-5-yl)morpholine has a molecular weight of 155.16 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(5H-tetrazol-5-yl)morpholine is sourced from PubChem (CID 129389237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).