1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol

C10H19N3O4S — CID 165473027

IUPAC1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol
SMILESCOCCNCC(O)Cn1cc(S(C)(=O)=O)cn1
InChIInChI=1S/C10H19N3O4S/c1-17-4-3-11-5-9(14)7-13-8-10(6-12-13)18(2,15)16/h6,8-9,11,14H,3-5,7H2,1-2H3
InChIKeyUZIKETFLRGKYIG-UHFFFAOYSA-N
MW277.35 g/mol
LogP-1.12
Rot. Bonds8

About 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol

1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol (PubChem CID 165473027) has the molecular formula C10H19N3O4S and a molecular weight of 277.35 g/mol. Its IUPAC name is 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol
PubChem CID165473027
Molecular FormulaC10H19N3O4S
Molecular Weight277.35 g/mol
Exact Mass277.11
IUPAC Name1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol
SMILESCOCCNCC(O)Cn1cc(S(C)(=O)=O)cn1
InChIInChI=1S/C10H19N3O4S/c1-17-4-3-11-5-9(14)7-13-8-10(6-12-13)18(2,15)16/h6,8-9,11,14H,3-5,7H2,1-2H3
InChIKeyUZIKETFLRGKYIG-UHFFFAOYSA-N
XLogP-1.12
TPSA93.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 5-1.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol 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

1-(2-methoxyethylamino)-3-[4-(trifluoromethyl)pyrazol-1-yl]propan-2-ol
CID 115475769
(2R)-1-(4-methylsulfonylpyrazol-1-yl)propan-2-ol
CID 165472464
5-(4-methylsulfonylpyrazol-1-yl)-1-(propylamino)pentan-2-ol
CID 165473024
1-(4-nitropyrazol-1-yl)-3-(2-propan-2-yloxyethylamino)propan-2-ol
CID 104760165
1-[2-[2-methoxyethyl(methyl)amino]ethylamino]-3-(4-nitropyrazol-1-yl)propan-2-ol
CID 62845026
(2R)-1-(4-methylsulfonylpyrazol-1-yl)propan-2-amine
CID 165473094
5-chloro-1-[2-hydroxy-3-(2-methoxyethylamino)propyl]pyrimidin-2-one
CID 115475877
2-amino-3-(4-methylsulfonylpyrazol-1-yl)propanoic acid
CID 165480243
1-(4-chlorophenyl)sulfonyl-3-(2-methoxyethylamino)propan-2-ol
CID 115476465
5-(4-methylsulfonylpyrazol-1-yl)pentan-2-ol
CID 165472463
3,3-dimethyl-1-(4-methylsulfonylpyrazol-1-yl)butan-2-amine
CID 165471755
5-(diethylamino)-2-[2-hydroxy-3-(2-methoxyethylamino)propyl]pyridazin-3-one
CID 114395471

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol?
The IUPAC name of 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol (CID 165473027) is 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol.
What is the SMILES notation for 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol?
The canonical SMILES for 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol is COCCNCC(O)Cn1cc(S(C)(=O)=O)cn1.
What is the InChIKey of 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol?
The InChIKey is UZIKETFLRGKYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O4S/c1-17-4-3-11-5-9(14)7-13-8-10(6-12-13)18(2,15)16/h6,8-9,11,14H,3-5,7H2,1-2H3.
What are the key properties of 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol?
1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol has a molecular weight of 277.35 g/mol, XLogP of -1.12, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethylamino)-3-(4-methylsulfonylpyrazol-1-yl)propan-2-ol is sourced from PubChem (CID 165473027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).