2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine

C15H21N5O5S — CID 155507407

IUPAC2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine
SMILESCOCCn1nnc(C2CN(S(=O)(=O)c3ccc(OC)cc3)CCO2)n1
InChIInChI=1S/C15H21N5O5S/c1-23-9-8-20-17-15(16-18-20)14-11-19(7-10-25-14)26(21,22)13-5-3-12(24-2)4-6-13/h3-6,14H,7-11H2,1-2H3
InChIKeyQJIZIQSJRDLOMS-UHFFFAOYSA-N
MW383.43 g/mol
LogP0.09
Rot. Bonds7

About 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine

2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine (PubChem CID 155507407) has the molecular formula C15H21N5O5S and a molecular weight of 383.43 g/mol. Its IUPAC name is 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine.

Molecular Properties

Compound Name2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine
PubChem CID155507407
Molecular FormulaC15H21N5O5S
Molecular Weight383.43 g/mol
Exact Mass383.13
IUPAC Name2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine
SMILESCOCCn1nnc(C2CN(S(=O)(=O)c3ccc(OC)cc3)CCO2)n1
InChIInChI=1S/C15H21N5O5S/c1-23-9-8-20-17-15(16-18-20)14-11-19(7-10-25-14)26(21,22)13-5-3-12(24-2)4-6-13/h3-6,14H,7-11H2,1-2H3
InChIKeyQJIZIQSJRDLOMS-UHFFFAOYSA-N
XLogP0.09
TPSA108.67 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.43
LogP ≤ 50.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

3-[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]sulfonylbenzoic acid
CID 155497759
4-(4-ethylphenyl)sulfonyl-2-(4-methoxyphenyl)morpholine
CID 110327245
3-[4-(4-methoxyphenyl)sulfonylmorpholin-2-yl]pyrazin-2-amine
CID 110112775
2-(2-chlorophenyl)-4-(4-methoxyphenyl)sulfonylmorpholine
CID 110326898
1-[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]-3-phenoxypropan-1-one
CID 155493815
2-(4-methoxyphenyl)-4-(4-propan-2-ylphenyl)sulfonylmorpholine
CID 110327247
(2R)-2-(5-ethyl-1,3,4-oxadiazol-2-yl)-4-[4-(2-methoxyethoxy)phenyl]sulfonylmorpholine
CID 129327274
1-[2-[2-(2-methoxyethyl)tetrazol-5-yl]morpholin-4-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 72875963
4-(3,4-dimethylphenyl)sulfonyl-2-(4-methoxyphenyl)morpholine
CID 110327242
4-(4-methoxyphenyl)sulfonylmorpholine-2-carbonitrile
CID 78946237
2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]morpholine
CID 155914582
(2S)-2-[5-[2-(4-methoxyphenoxy)ethyl]-1-methylpyrazol-3-yl]-N,N-dimethylmorpholine-4-sulfonamide
CID 124968540

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine?
The IUPAC name of 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine (CID 155507407) is 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine.
What is the SMILES notation for 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine?
The canonical SMILES for 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine is COCCn1nnc(C2CN(S(=O)(=O)c3ccc(OC)cc3)CCO2)n1.
What is the InChIKey of 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine?
The InChIKey is QJIZIQSJRDLOMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O5S/c1-23-9-8-20-17-15(16-18-20)14-11-19(7-10-25-14)26(21,22)13-5-3-12(24-2)4-6-13/h3-6,14H,7-11H2,1-2H3.
What are the key properties of 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine?
2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine has a molecular weight of 383.43 g/mol, XLogP of 0.09, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethyl)tetrazol-5-yl]-4-(4-methoxyphenyl)sulfonylmorpholine is sourced from PubChem (CID 155507407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).