1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide

C17H24N4O3S — CID 51853490

IUPAC1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide
SMILESCc1c(S(=O)(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cnn1C
InChIInChI=1S/C17H24N4O3S/c1-14-17(13-18-20(14)2)25(22,23)19-12-16(15-6-4-3-5-7-15)21-8-10-24-11-9-21/h3-7,13,16,19H,8-12H2,1-2H3/t16-/m0/s1
InChIKeyKITWKYJOVWMRIR-INIZCTEOSA-N
MW364.47 g/mol
LogP1.08
Rot. Bonds6

About 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide

1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide (PubChem CID 51853490) has the molecular formula C17H24N4O3S and a molecular weight of 364.47 g/mol. Its IUPAC name is 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide
PubChem CID51853490
Molecular FormulaC17H24N4O3S
Molecular Weight364.47 g/mol
Exact Mass364.16
IUPAC Name1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide
SMILESCc1c(S(=O)(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cnn1C
InChIInChI=1S/C17H24N4O3S/c1-14-17(13-18-20(14)2)25(22,23)19-12-16(15-6-4-3-5-7-15)21-8-10-24-11-9-21/h3-7,13,16,19H,8-12H2,1-2H3/t16-/m0/s1
InChIKeyKITWKYJOVWMRIR-INIZCTEOSA-N
XLogP1.08
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide with MolForge

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Related Compounds

N-[(2S)-2-morpholin-4-yl-2-phenylethyl]benzenesulfonamide
CID 746168
2,4-difluoro-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]benzenesulfonamide
CID 94008610
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-methylsulfonylbenzenesulfonamide
CID 55558714
N-[(2S)-2-morpholin-4-yl-2-phenylethyl]-1,3-benzothiazole-4-sulfonamide
CID 124741959
2-chloro-5-methylsulfonyl-N-(2-morpholin-4-yl-2-phenylethyl)benzenesulfonamide
CID 55598948
2-bromo-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]benzenesulfonamide
CID 75875408
2-chloro-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]benzenesulfonamide
CID 75748883
2,5-dimethyl-N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)benzenesulfonamide
CID 112506407
N-(2-morpholin-4-yl-2-phenylethyl)naphthalene-2-sulfonamide
CID 47023208
8-methoxy-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-5-sulfonamide
CID 47062207
3-fluoro-N-(2-morpholin-4-yl-2-phenylethyl)benzenesulfonamide
CID 47023210
4-methyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-3-ylethyl]benzenesulfonamide
CID 30888568

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide?
The IUPAC name of 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide (CID 51853490) is 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide.
What is the SMILES notation for 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide?
The canonical SMILES for 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide is Cc1c(S(=O)(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cnn1C.
What is the InChIKey of 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide?
The InChIKey is KITWKYJOVWMRIR-INIZCTEOSA-N. The full InChI is InChI=1S/C17H24N4O3S/c1-14-17(13-18-20(14)2)25(22,23)19-12-16(15-6-4-3-5-7-15)21-8-10-24-11-9-21/h3-7,13,16,19H,8-12H2,1-2H3/t16-/m0/s1.
What are the key properties of 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide?
1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide has a molecular weight of 364.47 g/mol, XLogP of 1.08, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-phenylethyl]pyrazole-4-sulfonamide is sourced from PubChem (CID 51853490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).