(2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide

C12H22N4O3S — CID 100845308

IUPAC(2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide
SMILESC[C@H](Cn1cccn1)NS(=O)(=O)N1C[C@H](C)O[C@@H](C)C1
InChIInChI=1S/C12H22N4O3S/c1-10(7-15-6-4-5-13-15)14-20(17,18)16-8-11(2)19-12(3)9-16/h4-6,10-12,14H,7-9H2,1-3H3/t10-,11+,12+/m1/s1
InChIKeyQFZSWKZZCVWCJR-WOPDTQHZSA-N
MW302.40 g/mol
LogP0.22
Rot. Bonds5

About (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide

(2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide (PubChem CID 100845308) has the molecular formula C12H22N4O3S and a molecular weight of 302.40 g/mol. Its IUPAC name is (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide.

Molecular Properties

Compound Name(2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide
PubChem CID100845308
Molecular FormulaC12H22N4O3S
Molecular Weight302.40 g/mol
Exact Mass302.14
IUPAC Name(2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide
SMILESC[C@H](Cn1cccn1)NS(=O)(=O)N1C[C@H](C)O[C@@H](C)C1
InChIInChI=1S/C12H22N4O3S/c1-10(7-15-6-4-5-13-15)14-20(17,18)16-8-11(2)19-12(3)9-16/h4-6,10-12,14H,7-9H2,1-3H3/t10-,11+,12+/m1/s1
InChIKeyQFZSWKZZCVWCJR-WOPDTQHZSA-N
XLogP0.22
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide 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

N-butan-2-yl-2,6-dimethylmorpholine-4-sulfonamide
CID 42936366
4-(methylaminomethyl)-N-(1-pyrazol-1-ylpropan-2-yl)piperidine-1-sulfonamide
CID 106009682
(2R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-methyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]butanamide
CID 100842753
(2R,6S)-2,6-dimethyl-N-propan-2-ylmorpholine-4-sulfonamide
CID 165470689
(2S)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]propan-2-ol
CID 98758880
2,6-dimethyl-4-(2-pyrazol-1-ylethyl)morpholine
CID 172900914
N-(1-hydroxybutan-2-yl)-2,6-dimethylmorpholine-4-sulfonamide
CID 43501588
1-(cyclopentanecarbonyl)-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]azetidine-3-sulfonamide
CID 97348412
3-amino-1,5-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrazole-4-sulfonamide
CID 105358699
4-amino-2,6-dimethyl-N-(1-pyrazol-1-ylpropan-2-yl)benzenesulfonamide
CID 79569041
4-chloro-N-(1-pyrazol-1-ylpropan-2-yl)butane-1-sulfonamide
CID 116815471
3,5-dimethyl-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]-1,2-oxazole-4-sulfonamide
CID 94162195

Frequently Asked Questions

What is the IUPAC name of (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide?
The IUPAC name of (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide (CID 100845308) is (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide.
What is the SMILES notation for (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide?
The canonical SMILES for (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide is C[C@H](Cn1cccn1)NS(=O)(=O)N1C[C@H](C)O[C@@H](C)C1.
What is the InChIKey of (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide?
The InChIKey is QFZSWKZZCVWCJR-WOPDTQHZSA-N. The full InChI is InChI=1S/C12H22N4O3S/c1-10(7-15-6-4-5-13-15)14-20(17,18)16-8-11(2)19-12(3)9-16/h4-6,10-12,14H,7-9H2,1-3H3/t10-,11+,12+/m1/s1.
What are the key properties of (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide?
(2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide has a molecular weight of 302.40 g/mol, XLogP of 0.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,6S)-2,6-dimethyl-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-sulfonamide is sourced from PubChem (CID 100845308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).