N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide

C19H23N3O3S2 — CID 41269183

IUPACN-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C19H23N3O3S2/c23-19(20-15-9-11-22(12-10-15)17-7-8-17)14-3-5-16(6-4-14)21-27(24,25)18-2-1-13-26-18/h1-6,13,15,17,21H,7-12H2,(H,20,23)
InChIKeySINUODOSMQJWBU-UHFFFAOYSA-N
MW405.55 g/mol
LogP2.91
Rot. Bonds6

About N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide

N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide (PubChem CID 41269183) has the molecular formula C19H23N3O3S2 and a molecular weight of 405.55 g/mol. Its IUPAC name is N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide.

Molecular Properties

Compound NameN-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide
PubChem CID41269183
Molecular FormulaC19H23N3O3S2
Molecular Weight405.55 g/mol
Exact Mass405.12
IUPAC NameN-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C19H23N3O3S2/c23-19(20-15-9-11-22(12-10-15)17-7-8-17)14-3-5-16(6-4-14)21-27(24,25)18-2-1-13-26-18/h1-6,13,15,17,21H,7-12H2,(H,20,23)
InChIKeySINUODOSMQJWBU-UHFFFAOYSA-N
XLogP2.91
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.55
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 24504177
4-fluoro-N-(1-thiophen-2-ylsulfonylpiperidin-4-yl)benzamide
CID 35400940
N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide
CID 60730497
N-[1-(3-methylbut-2-enyl)piperidin-4-yl]-2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetamide
CID 56569161
N-(3-piperidin-1-ylpropyl)-4-(thiophen-2-ylsulfonylamino)benzamide
CID 18150972
N-(1-cyclopropylpiperidin-4-yl)-4-phenylbenzamide
CID 26131227
N-(1-cyclopropylpiperidin-4-yl)-4-(trifluoromethylsulfonyl)benzamide
CID 55567282
N-[4-[[[(2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carbonyl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide
CID 25340618
3-hydroxy-N-(1-thiophen-2-ylsulfonylpiperidin-4-yl)benzamide
CID 108562969
N-ethoxy-4-(thiophen-2-ylsulfonylamino)benzamide
CID 17470879
methyl 2-[[4-(thiophen-2-ylsulfonylamino)benzoyl]amino]acetate
CID 8840841
N-(2,2-dimethyl-3,4-dihydrochromen-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide
CID 132672537

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide?
The IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide (CID 41269183) is N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide.
What is the SMILES notation for N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide?
The canonical SMILES for N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide is O=C(NC1CCN(C2CC2)CC1)c1ccc(NS(=O)(=O)c2cccs2)cc1.
What is the InChIKey of N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide?
The InChIKey is SINUODOSMQJWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S2/c23-19(20-15-9-11-22(12-10-15)17-7-8-17)14-3-5-16(6-4-14)21-27(24,25)18-2-1-13-26-18/h1-6,13,15,17,21H,7-12H2,(H,20,23).
What are the key properties of N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide?
N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide has a molecular weight of 405.55 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpiperidin-4-yl)-4-(thiophen-2-ylsulfonylamino)benzamide is sourced from PubChem (CID 41269183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).