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

C14H19N3O6S — CID 9332160

IUPAC(2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
SMILESC[C@H](Oc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)NC(N)=O
InChIInChI=1S/C14H19N3O6S/c1-10(13(18)16-14(15)19)23-11-2-4-12(5-3-11)24(20,21)17-6-8-22-9-7-17/h2-5,10H,6-9H2,1H3,(H3,15,16,18,19)/t10-/m0/s1
InChIKeyRZQZJGGGCVHNHY-JTQLQIEISA-N
MW357.39 g/mol
LogP-0.33
Rot. Bonds5

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

(2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide (PubChem CID 9332160) has the molecular formula C14H19N3O6S and a molecular weight of 357.39 g/mol. Its IUPAC name is (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide.

Molecular Properties

Compound Name(2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
PubChem CID9332160
Molecular FormulaC14H19N3O6S
Molecular Weight357.39 g/mol
Exact Mass357.10
IUPAC Name(2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide
SMILESC[C@H](Oc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)NC(N)=O
InChIInChI=1S/C14H19N3O6S/c1-10(13(18)16-14(15)19)23-11-2-4-12(5-3-11)24(20,21)17-6-8-22-9-7-17/h2-5,10H,6-9H2,1H3,(H3,15,16,18,19)/t10-/m0/s1
InChIKeyRZQZJGGGCVHNHY-JTQLQIEISA-N
XLogP-0.33
TPSA128.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.39
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The IUPAC name of (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide (CID 9332160) is (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide.
What is the SMILES notation for (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The canonical SMILES for (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide is C[C@H](Oc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)NC(N)=O.
What is the InChIKey of (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
The InChIKey is RZQZJGGGCVHNHY-JTQLQIEISA-N. The full InChI is InChI=1S/C14H19N3O6S/c1-10(13(18)16-14(15)19)23-11-2-4-12(5-3-11)24(20,21)17-6-8-22-9-7-17/h2-5,10H,6-9H2,1H3,(H3,15,16,18,19)/t10-/m0/s1.
What are the key properties of (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide?
(2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide has a molecular weight of 357.39 g/mol, XLogP of -0.33, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-carbamoyl-2-(4-morpholin-4-ylsulfonylphenoxy)propanamide is sourced from PubChem (CID 9332160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).