(2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide

C16H22N2O5S — CID 41094222

IUPAC(2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
SMILESC[C@H](Oc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)NC1CC1
InChIInChI=1S/C16H22N2O5S/c1-12(16(19)17-13-2-3-13)23-14-4-6-15(7-5-14)24(20,21)18-8-10-22-11-9-18/h4-7,12-13H,2-3,8-11H2,1H3,(H,17,19)/t12-/m0/s1
InChIKeyZFGUCOGWLSRRQN-LBPRGKRZSA-N
MW354.43 g/mol
LogP0.75
Rot. Bonds6

About (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide

(2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide (PubChem CID 41094222) has the molecular formula C16H22N2O5S and a molecular weight of 354.43 g/mol. Its IUPAC name is (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide.

Molecular Properties

Compound Name(2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
PubChem CID41094222
Molecular FormulaC16H22N2O5S
Molecular Weight354.43 g/mol
Exact Mass354.12
IUPAC Name(2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
SMILESC[C@H](Oc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)NC1CC1
InChIInChI=1S/C16H22N2O5S/c1-12(16(19)17-13-2-3-13)23-14-4-6-15(7-5-14)24(20,21)18-8-10-22-11-9-18/h4-7,12-13H,2-3,8-11H2,1H3,(H,17,19)/t12-/m0/s1
InChIKeyZFGUCOGWLSRRQN-LBPRGKRZSA-N
XLogP0.75
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-N-cyclopentyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
CID 9332126
(2R)-N-[(1S,2R)-2-methylcyclohexyl]-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
CID 9332032
(2R)-N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
CID 11939287
(2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
CID 9332160
methyl (2S)-2-(4-morpholin-4-ylsulfonylphenoxy)propanoate
CID 9331081
2-(4-methylphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 2983188
2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 3153549
(2S)-N-(3-methylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
CID 7612920
N-[2-(4-morpholin-4-ylsulfonylphenoxy)ethyl]-2-phenoxypropanamide
CID 133234857
2-(3-methylphenoxy)-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]propanamide
CID 18143238
[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 3-morpholin-4-ylsulfonylbenzoate
CID 7699481
N-[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-2-(4-hydroxyphenoxy)propanamide
CID 108560040

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The IUPAC name of (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide (CID 41094222) is (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide.
What is the SMILES notation for (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The canonical SMILES for (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide is C[C@H](Oc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)NC1CC1.
What is the InChIKey of (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The InChIKey is ZFGUCOGWLSRRQN-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H22N2O5S/c1-12(16(19)17-13-2-3-13)23-14-4-6-15(7-5-14)24(20,21)18-8-10-22-11-9-18/h4-7,12-13H,2-3,8-11H2,1H3,(H,17,19)/t12-/m0/s1.
What are the key properties of (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
(2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide has a molecular weight of 354.43 g/mol, XLogP of 0.75, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopropyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide is sourced from PubChem (CID 41094222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).