N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide

C18H29N3O3S — CID 49243207

IUPACN-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide
SMILESCCCN1CCC(N(C)S(=O)(=O)c2ccc(NC(=O)CC)cc2)CC1
InChIInChI=1S/C18H29N3O3S/c1-4-12-21-13-10-16(11-14-21)20(3)25(23,24)17-8-6-15(7-9-17)19-18(22)5-2/h6-9,16H,4-5,10-14H2,1-3H3,(H,19,22)
InChIKeyVSEJSCMYBRFBKM-UHFFFAOYSA-N
MW367.52 g/mol
LogP2.53
Rot. Bonds7

About N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide

N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide (PubChem CID 49243207) has the molecular formula C18H29N3O3S and a molecular weight of 367.52 g/mol. Its IUPAC name is N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide.

Molecular Properties

Compound NameN-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide
PubChem CID49243207
Molecular FormulaC18H29N3O3S
Molecular Weight367.52 g/mol
Exact Mass367.19
IUPAC NameN-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide
SMILESCCCN1CCC(N(C)S(=O)(=O)c2ccc(NC(=O)CC)cc2)CC1
InChIInChI=1S/C18H29N3O3S/c1-4-12-21-13-10-16(11-14-21)20(3)25(23,24)17-8-6-15(7-9-17)19-18(22)5-2/h6-9,16H,4-5,10-14H2,1-3H3,(H,19,22)
InChIKeyVSEJSCMYBRFBKM-UHFFFAOYSA-N
XLogP2.53
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.52
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(1-propylpiperidin-4-yl)amino]phenyl]propanamide
CID 43720611
N-[4-[[4-[cyclopropyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]sulfamoyl]phenyl]acetamide
CID 4143732
N-[4-[cyclopropyl(methyl)sulfamoyl]phenyl]-3,3,3-trifluoropropanamide
CID 71879297
N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 31305119
4-[4-[cyclohexyl(methyl)sulfamoyl]anilino]-4-oxobutanoic acid
CID 1266303
1-ethyl-3-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]urea
CID 9453496
N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]cyclopropanecarboxamide
CID 4924186
3-bromo-N-methyl-N-(1-propylpiperidin-4-yl)benzenesulfonamide
CID 61059874
N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(4-methylpyrazol-1-yl)acetamide
CID 55874325
N-[4-[cyclopropyl(methyl)sulfamoyl]phenyl]-2-(1-methoxycyclobutyl)acetamide
CID 119048273
N-[4-[methyl-(1-methylpiperidin-1-ium-4-yl)sulfamoyl]phenyl]-2-(2-methylphenyl)acetamide
CID 8850603
[4-[cyclohexyl(methyl)sulfamoyl]phenyl]urea
CID 135231517

Frequently Asked Questions

What is the IUPAC name of N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide?
The IUPAC name of N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide (CID 49243207) is N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide.
What is the SMILES notation for N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide?
The canonical SMILES for N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide is CCCN1CCC(N(C)S(=O)(=O)c2ccc(NC(=O)CC)cc2)CC1.
What is the InChIKey of N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide?
The InChIKey is VSEJSCMYBRFBKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O3S/c1-4-12-21-13-10-16(11-14-21)20(3)25(23,24)17-8-6-15(7-9-17)19-18(22)5-2/h6-9,16H,4-5,10-14H2,1-3H3,(H,19,22).
What are the key properties of N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide?
N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide has a molecular weight of 367.52 g/mol, XLogP of 2.53, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[methyl-(1-propylpiperidin-4-yl)sulfamoyl]phenyl]propanamide is sourced from PubChem (CID 49243207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).