N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide

C15H23N3O5S — CID 9224721

IUPACN-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide
SMILESCCNC(=O)CNC(=O)c1ccc(S(=O)(=O)N[C@H](C)COC)cc1
InChIInChI=1S/C15H23N3O5S/c1-4-16-14(19)9-17-15(20)12-5-7-13(8-6-12)24(21,22)18-11(2)10-23-3/h5-8,11,18H,4,9-10H2,1-3H3,(H,16,19)(H,17,20)/t11-/m1/s1
InChIKeyAVLYJFJOMYDSNP-LLVKDONJSA-N
MW357.43 g/mol
LogP-0.13
Rot. Bonds9

About N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide

N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide (PubChem CID 9224721) has the molecular formula C15H23N3O5S and a molecular weight of 357.43 g/mol. Its IUPAC name is N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide.

Molecular Properties

Compound NameN-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide
PubChem CID9224721
Molecular FormulaC15H23N3O5S
Molecular Weight357.43 g/mol
Exact Mass357.14
IUPAC NameN-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide
SMILESCCNC(=O)CNC(=O)c1ccc(S(=O)(=O)N[C@H](C)COC)cc1
InChIInChI=1S/C15H23N3O5S/c1-4-16-14(19)9-17-15(20)12-5-7-13(8-6-12)24(21,22)18-11(2)10-23-3/h5-8,11,18H,4,9-10H2,1-3H3,(H,16,19)(H,17,20)/t11-/m1/s1
InChIKeyAVLYJFJOMYDSNP-LLVKDONJSA-N
XLogP-0.13
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide?
The IUPAC name of N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide (CID 9224721) is N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide.
What is the SMILES notation for N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide?
The canonical SMILES for N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide is CCNC(=O)CNC(=O)c1ccc(S(=O)(=O)N[C@H](C)COC)cc1.
What is the InChIKey of N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide?
The InChIKey is AVLYJFJOMYDSNP-LLVKDONJSA-N. The full InChI is InChI=1S/C15H23N3O5S/c1-4-16-14(19)9-17-15(20)12-5-7-13(8-6-12)24(21,22)18-11(2)10-23-3/h5-8,11,18H,4,9-10H2,1-3H3,(H,16,19)(H,17,20)/t11-/m1/s1.
What are the key properties of N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide?
N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide has a molecular weight of 357.43 g/mol, XLogP of -0.13, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide is sourced from PubChem (CID 9224721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).