2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine

C14H23N3O4S — CID 129000221

IUPAC2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine
SMILESCCn1cc(C2CN(S(=O)(=O)CC3CCOC3)CCO2)cn1
InChIInChI=1S/C14H23N3O4S/c1-2-16-8-13(7-15-16)14-9-17(4-6-21-14)22(18,19)11-12-3-5-20-10-12/h7-8,12,14H,2-6,9-11H2,1H3
InChIKeyFTFAOZRVFCFYIJ-UHFFFAOYSA-N
MW329.42 g/mol
LogP0.64
Rot. Bonds5

About 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine

2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine (PubChem CID 129000221) has the molecular formula C14H23N3O4S and a molecular weight of 329.42 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine
PubChem CID129000221
Molecular FormulaC14H23N3O4S
Molecular Weight329.42 g/mol
Exact Mass329.14
IUPAC Name2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine
SMILESCCn1cc(C2CN(S(=O)(=O)CC3CCOC3)CCO2)cn1
InChIInChI=1S/C14H23N3O4S/c1-2-16-8-13(7-15-16)14-9-17(4-6-21-14)22(18,19)11-12-3-5-20-10-12/h7-8,12,14H,2-6,9-11H2,1H3
InChIKeyFTFAOZRVFCFYIJ-UHFFFAOYSA-N
XLogP0.64
TPSA73.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)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

(2R)-4-(cyclohexylmethylsulfonyl)-2-(1-ethylpyrazol-4-yl)morpholine
CID 129400024
(2R)-2-(1-ethylpyrazol-4-yl)-4-[2-[(2R)-oxolan-2-yl]ethylsulfonyl]morpholine
CID 129430932
(2R)-4-(3,5-dichlorophenyl)sulfonyl-2-(1-ethylpyrazol-4-yl)morpholine
CID 99827482
(2R)-4-(2-ethylphenyl)sulfonyl-2-(1-ethylpyrazol-4-yl)morpholine
CID 99827504
(2R)-2-(1-ethylpyrazol-4-yl)-4-(4-propylphenyl)sulfonylmorpholine
CID 99827489
(2R)-4-(5-chlorothiophen-2-yl)sulfonyl-2-(1-ethylpyrazol-4-yl)morpholine
CID 129400004
3-[[(2R)-2-(1-ethylpyrazol-4-yl)morpholin-4-yl]sulfonylmethyl]benzonitrile
CID 129399974
4-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]sulfonyl-2-(1-ethylpyrazol-4-yl)morpholine
CID 129001054
(2R)-4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2-(1-ethylpyrazol-4-yl)morpholine
CID 129400028
(2S)-2-(1-ethylpyrazol-4-yl)-4-(3-propan-2-ylphenyl)sulfonylmorpholine
CID 99827501
5-chloro-3-[2-(1-ethylpyrazol-4-yl)morpholin-4-yl]sulfonylpyridin-2-amine
CID 129001445
(2R)-2-(1-ethylpyrazol-4-yl)-4-[1-(2-methylpropyl)imidazol-4-yl]sulfonylmorpholine
CID 129400016

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine (CID 129000221) is 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine is CCn1cc(C2CN(S(=O)(=O)CC3CCOC3)CCO2)cn1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine?
The InChIKey is FTFAOZRVFCFYIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O4S/c1-2-16-8-13(7-15-16)14-9-17(4-6-21-14)22(18,19)11-12-3-5-20-10-12/h7-8,12,14H,2-6,9-11H2,1H3.
What are the key properties of 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine?
2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine has a molecular weight of 329.42 g/mol, XLogP of 0.64, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)-4-(oxolan-3-ylmethylsulfonyl)morpholine is sourced from PubChem (CID 129000221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).