4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide

C19H21N3O3S — CID 17416490

IUPAC4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCc1ccc(C2=CCN(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)cc1
InChIInChI=1S/C19H21N3O3S/c1-14-2-4-15(5-3-14)16-10-12-22(13-11-16)19(23)21-17-6-8-18(9-7-17)26(20,24)25/h2-10H,11-13H2,1H3,(H,21,23)(H2,20,24,25)
InChIKeyOHYOFKXJKTWEAC-UHFFFAOYSA-N
MW371.46 g/mol
LogP2.96
Rot. Bonds3

About 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide

4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 17416490) has the molecular formula C19H21N3O3S and a molecular weight of 371.46 g/mol. Its IUPAC name is 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound Name4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID17416490
Molecular FormulaC19H21N3O3S
Molecular Weight371.46 g/mol
Exact Mass371.13
IUPAC Name4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCc1ccc(C2=CCN(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)cc1
InChIInChI=1S/C19H21N3O3S/c1-14-2-4-15(5-3-14)16-10-12-22(13-11-16)19(23)21-17-6-8-18(9-7-17)26(20,24)25/h2-10H,11-13H2,1H3,(H,21,23)(H2,20,24,25)
InChIKeyOHYOFKXJKTWEAC-UHFFFAOYSA-N
XLogP2.96
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-sulfamoylphenyl)azocane-1-carboxamide
CID 17414007
(3S,5S)-3,5-dimethyl-N-(4-sulfamoylphenyl)piperidine-1-carboxamide
CID 40794398
1-N,4-N-bis(4-methylphenyl)piperazine-1,4-dicarboxamide
CID 4055899
4-cyclopropylidene-N-(4-methylphenyl)piperidine-1-carboxamide
CID 121187165
N-(4-sulfamoylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 24651018
N-(2-chloro-5-sulfamoylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 72858954
(4aS,8aS)-N-(4-sulfamoylphenyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide
CID 40874748
N-(4-acetylphenyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 115766537
[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 26877456
1-(4-methylphenyl)sulfonyl-N-(4-sulfamoylphenyl)piperidine-3-carboxamide
CID 16863432
4-(4-chlorophenyl)-N-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide
CID 58867035
4-(6-methylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 157444833

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide (CID 17416490) is 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide is Cc1ccc(C2=CCN(C(=O)Nc3ccc(S(N)(=O)=O)cc3)CC2)cc1.
What is the InChIKey of 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is OHYOFKXJKTWEAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3S/c1-14-2-4-15(5-3-14)16-10-12-22(13-11-16)19(23)21-17-6-8-18(9-7-17)26(20,24)25/h2-10H,11-13H2,1H3,(H,21,23)(H2,20,24,25).
What are the key properties of 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide?
4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 371.46 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylphenyl)-N-(4-sulfamoylphenyl)-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 17416490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).