N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide

C26H31N3O4S — CID 20973102

IUPACN-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide
SMILESO=C(NC1CC1)C1CCN(C(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)CCCC4)cc2)CC1
InChIInChI=1S/C26H31N3O4S/c30-25(27-22-10-11-22)19-13-15-29(16-14-19)26(31)20-5-8-23(9-6-20)28-34(32,33)24-12-7-18-3-1-2-4-21(18)17-24/h5-9,12,17,19,22,28H,1-4,10-11,13-16H2,(H,27,30)
InChIKeyXOZUTZGQBMWTAE-UHFFFAOYSA-N
MW481.62 g/mol
LogP3.50
Rot. Bonds6

About N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide

N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide (PubChem CID 20973102) has the molecular formula C26H31N3O4S and a molecular weight of 481.62 g/mol. Its IUPAC name is N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide
PubChem CID20973102
Molecular FormulaC26H31N3O4S
Molecular Weight481.62 g/mol
Exact Mass481.20
IUPAC NameN-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide
SMILESO=C(NC1CC1)C1CCN(C(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)CCCC4)cc2)CC1
InChIInChI=1S/C26H31N3O4S/c30-25(27-22-10-11-22)19-13-15-29(16-14-19)26(31)20-5-8-23(9-6-20)28-34(32,33)24-12-7-18-3-1-2-4-21(18)17-24/h5-9,12,17,19,22,28H,1-4,10-11,13-16H2,(H,27,30)
InChIKeyXOZUTZGQBMWTAE-UHFFFAOYSA-N
XLogP3.50
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.62
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide 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

N-cyclopropyl-1-[4-[(4-fluoro-3-methylphenyl)sulfonylamino]benzoyl]piperidine-4-carboxamide
CID 55954695
N-cyclopentyl-1-[4-[(4-methylphenyl)sulfonylamino]benzoyl]piperidine-4-carboxamide;2,2,2-trifluoroacetic acid
CID 146062956
N-cyclopropyl-1-[3-[(4-methylphenyl)sulfonylamino]benzoyl]piperidine-4-carboxamide
CID 20974007
1-[3-[(4-tert-butylphenyl)sulfonylamino]benzoyl]-N-cyclopropylpiperidine-4-carboxamide
CID 20974013
N-propan-2-yl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-3-carboxamide;2,2,2-trifluoroacetic acid
CID 163336564
1-[2-chloro-5-[(3,4-dimethylphenyl)sulfamoyl]benzoyl]-N-cyclopropylpiperidine-4-carboxamide
CID 55954056
1-[4-(benzenesulfonamido)benzoyl]-N-phenylpiperidine-4-carboxamide
CID 55410159
N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 16944293
1-(4-chlorobenzoyl)-N-cyclopropylpiperidine-4-carboxamide
CID 1072789
1-[4-[(4-acetamidophenyl)sulfonylamino]benzoyl]-N-propan-2-ylpiperidine-4-carboxamide
CID 20973047
(3S)-N-cyclohexyl-1-[4-[(4-fluorophenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide
CID 92729184
N-cycloheptyl-1-[4-[(4-methylphenyl)sulfonylamino]benzoyl]piperidine-3-carboxamide
CID 46384573

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide?
The IUPAC name of N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide (CID 20973102) is N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide is O=C(NC1CC1)C1CCN(C(=O)c2ccc(NS(=O)(=O)c3ccc4c(c3)CCCC4)cc2)CC1.
What is the InChIKey of N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide?
The InChIKey is XOZUTZGQBMWTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H31N3O4S/c30-25(27-22-10-11-22)19-13-15-29(16-14-19)26(31)20-5-8-23(9-6-20)28-34(32,33)24-12-7-18-3-1-2-4-21(18)17-24/h5-9,12,17,19,22,28H,1-4,10-11,13-16H2,(H,27,30).
What are the key properties of N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide?
N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide has a molecular weight of 481.62 g/mol, XLogP of 3.50, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoyl]piperidine-4-carboxamide is sourced from PubChem (CID 20973102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).