1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea

C19H30N4O3S — CID 119045061

IUPAC1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea
SMILESCCN1CCCC(NC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)C1
InChIInChI=1S/C19H30N4O3S/c1-2-23-13-5-8-17(14-23)21-19(24)20-15-9-11-18(12-10-15)27(25,26)22-16-6-3-4-7-16/h9-12,16-17,22H,2-8,13-14H2,1H3,(H2,20,21,24)
InChIKeyZUUWUZFLNCJSGQ-UHFFFAOYSA-N
MW394.54 g/mol
LogP2.51
Rot. Bonds6

About 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea

1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea (PubChem CID 119045061) has the molecular formula C19H30N4O3S and a molecular weight of 394.54 g/mol. Its IUPAC name is 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea.

Molecular Properties

Compound Name1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea
PubChem CID119045061
Molecular FormulaC19H30N4O3S
Molecular Weight394.54 g/mol
Exact Mass394.20
IUPAC Name1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea
SMILESCCN1CCCC(NC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)C1
InChIInChI=1S/C19H30N4O3S/c1-2-23-13-5-8-17(14-23)21-19(24)20-15-9-11-18(12-10-15)27(25,26)22-16-6-3-4-7-16/h9-12,16-17,22H,2-8,13-14H2,1H3,(H2,20,21,24)
InChIKeyZUUWUZFLNCJSGQ-UHFFFAOYSA-N
XLogP2.51
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.54
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea 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

1-cyclopentyl-3-[4-(cyclopentylsulfamoyl)phenyl]urea
CID 119045085
1-[4-(cyclopentylsulfamoyl)phenyl]-3-cyclopropylurea
CID 119045070
N-(1-ethylpiperidin-3-yl)-4-hydroxybenzenesulfonamide
CID 61478239
1-(3,4-dichlorophenyl)-3-(1-ethylpiperidin-3-yl)urea
CID 47349344
N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 1166743
N-[(3R)-1-ethylpiperidin-3-yl]-4-propan-2-ylbenzenesulfonamide
CID 52534305
4-(aminomethyl)-N-(1-ethylpiperidin-3-yl)benzenesulfonamide
CID 61476754
1-cyclopentyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589989
ethane;N-(1-ethylpiperidin-3-yl)benzenesulfonamide;molecular hydrogen
CID 162749983
1-cyclopropyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589816
N-[(3S)-1-ethylpiperidin-3-yl]naphthalene-2-sulfonamide
CID 52534323
1-ethyl-N-(4-ethylsulfonylphenyl)piperidin-3-amine
CID 61170389

Frequently Asked Questions

What is the IUPAC name of 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea?
The IUPAC name of 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea (CID 119045061) is 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea.
What is the SMILES notation for 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea?
The canonical SMILES for 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea is CCN1CCCC(NC(=O)Nc2ccc(S(=O)(=O)NC3CCCC3)cc2)C1.
What is the InChIKey of 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea?
The InChIKey is ZUUWUZFLNCJSGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O3S/c1-2-23-13-5-8-17(14-23)21-19(24)20-15-9-11-18(12-10-15)27(25,26)22-16-6-3-4-7-16/h9-12,16-17,22H,2-8,13-14H2,1H3,(H2,20,21,24).
What are the key properties of 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea?
1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea has a molecular weight of 394.54 g/mol, XLogP of 2.51, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(cyclopentylsulfamoyl)phenyl]-3-(1-ethylpiperidin-3-yl)urea is sourced from PubChem (CID 119045061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).