(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide

C14H20Cl2N2O4S — CID 126397173

IUPAC(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide
SMILESCCOCCCNC(=O)[C@@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C14H20Cl2N2O4S/c1-3-22-8-4-7-17-14(19)10(2)18-23(20,21)13-9-11(15)5-6-12(13)16/h5-6,9-10,18H,3-4,7-8H2,1-2H3,(H,17,19)/t10-/m1/s1
InChIKeySIKGUNYQBWVTJT-SNVBAGLBSA-N
MW383.30 g/mol
LogP2.20
Rot. Bonds9

About (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide

(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide (PubChem CID 126397173) has the molecular formula C14H20Cl2N2O4S and a molecular weight of 383.30 g/mol. Its IUPAC name is (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide.

Molecular Properties

Compound Name(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide
PubChem CID126397173
Molecular FormulaC14H20Cl2N2O4S
Molecular Weight383.30 g/mol
Exact Mass382.05
IUPAC Name(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide
SMILESCCOCCCNC(=O)[C@@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C14H20Cl2N2O4S/c1-3-22-8-4-7-17-14(19)10(2)18-23(20,21)13-9-11(15)5-6-12(13)16/h5-6,9-10,18H,3-4,7-8H2,1-2H3,(H,17,19)/t10-/m1/s1
InChIKeySIKGUNYQBWVTJT-SNVBAGLBSA-N
XLogP2.20
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.30
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-methoxypropyl)propanamide
CID 126392529
2-[(5-chloro-2-ethoxyphenyl)sulfonylamino]-N-(3-propan-2-yloxypropyl)propanamide
CID 43890415
2-[(5-chloro-2-ethoxyphenyl)sulfonylamino]-N-(3-hydroxypropyl)propanamide
CID 43890329
2,5-dichloro-N-(1-hydrazinyl-1-oxopropan-2-yl)benzenesulfonamide
CID 4320202
N-(3-ethoxypropyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
CID 5181222
(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(pyridin-4-ylmethyl)propanamide
CID 126393592
(2S)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2-ethylphenyl)propanamide
CID 124550207
2-[(2,5-dichlorophenyl)sulfonylamino]-N,N'-dihexylpentanediamide
CID 44565357
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 126394209
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2,6-dimethylphenyl)propanamide
CID 124549696
2-(2,5-dichlorophenoxy)-N-(3-ethoxypropyl)acetamide
CID 84601595
2,5-dichloro-N-[(2S)-1-methoxypropan-2-yl]benzenesulfonamide
CID 670298

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide?
The IUPAC name of (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide (CID 126397173) is (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide.
What is the SMILES notation for (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide?
The canonical SMILES for (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide is CCOCCCNC(=O)[C@@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide?
The InChIKey is SIKGUNYQBWVTJT-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H20Cl2N2O4S/c1-3-22-8-4-7-17-14(19)10(2)18-23(20,21)13-9-11(15)5-6-12(13)16/h5-6,9-10,18H,3-4,7-8H2,1-2H3,(H,17,19)/t10-/m1/s1.
What are the key properties of (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide?
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide has a molecular weight of 383.30 g/mol, XLogP of 2.20, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(3-ethoxypropyl)propanamide is sourced from PubChem (CID 126397173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).