3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide

C22H35N3O4S — CID 25336261

IUPAC3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide
SMILESCC(C)CNc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)CCC1CCCC1
InChIInChI=1S/C22H35N3O4S/c1-17(2)16-23-20-9-8-19(30(27,28)25-11-13-29-14-12-25)15-21(20)24-22(26)10-7-18-5-3-4-6-18/h8-9,15,17-18,23H,3-7,10-14,16H2,1-2H3,(H,24,26)
InChIKeyHQKABXVGKXXDOI-UHFFFAOYSA-N
MW437.61 g/mol
LogP3.68
Rot. Bonds9

About 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide

3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide (PubChem CID 25336261) has the molecular formula C22H35N3O4S and a molecular weight of 437.61 g/mol. Its IUPAC name is 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide
PubChem CID25336261
Molecular FormulaC22H35N3O4S
Molecular Weight437.61 g/mol
Exact Mass437.23
IUPAC Name3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide
SMILESCC(C)CNc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)CCC1CCCC1
InChIInChI=1S/C22H35N3O4S/c1-17(2)16-23-20-9-8-19(30(27,28)25-11-13-29-14-12-25)15-21(20)24-22(26)10-7-18-5-3-4-6-18/h8-9,15,17-18,23H,3-7,10-14,16H2,1-2H3,(H,24,26)
InChIKeyHQKABXVGKXXDOI-UHFFFAOYSA-N
XLogP3.68
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.61
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]acetamide
CID 98606271
2-cyclopentyl-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide
CID 4798720
4-ethoxy-N-[5-morpholin-4-ylsulfonyl-2-(oxolan-2-ylmethylamino)phenyl]butanamide
CID 55761995
2-amino-N-[5-morpholin-4-ylsulfonyl-2-(oxolan-2-ylmethylamino)phenyl]acetamide
CID 119266422
N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]naphthalene-2-sulfonamide
CID 5194420
N-(2-methylpropylcarbamoyl)-2-[5-morpholin-4-ylsulfonyl-2-(oxolan-2-ylmethylamino)anilino]acetamide
CID 55365412
N-[2-(ethylamino)-5-morpholin-4-ylsulfonylphenyl]-2-(methylamino)acetamide;hydrochloride
CID 119680614
3-cyclohexyl-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)propanamide
CID 43008044
3-cyclohexyl-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]propanamide
CID 3510468
N-[5-morpholin-4-ylsulfonyl-2-(oxolan-2-ylmethylamino)phenyl]cyclohexanecarboxamide
CID 42948457
[2-(2-methyl-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-cyclopentylacetate
CID 7722474
N-[2-(ethylamino)-5-morpholin-4-ylsulfonylphenyl]cyclohex-3-ene-1-carboxamide
CID 42948466

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide (CID 25336261) is 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide is CC(C)CNc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)CCC1CCCC1.
What is the InChIKey of 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide?
The InChIKey is HQKABXVGKXXDOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N3O4S/c1-17(2)16-23-20-9-8-19(30(27,28)25-11-13-29-14-12-25)15-21(20)24-22(26)10-7-18-5-3-4-6-18/h8-9,15,17-18,23H,3-7,10-14,16H2,1-2H3,(H,24,26).
What are the key properties of 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide?
3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide has a molecular weight of 437.61 g/mol, XLogP of 3.68, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[2-(2-methylpropylamino)-5-morpholin-4-ylsulfonylphenyl]propanamide is sourced from PubChem (CID 25336261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).