4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide

C19H26N4O4S — CID 33387816

IUPAC4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide
SMILESCOc1ccc2cc(CNC(=O)N3CCN(S(=O)(=O)N(C)C)CC3)ccc2c1
InChIInChI=1S/C19H26N4O4S/c1-21(2)28(25,26)23-10-8-22(9-11-23)19(24)20-14-15-4-5-17-13-18(27-3)7-6-16(17)12-15/h4-7,12-13H,8-11,14H2,1-3H3,(H,20,24)
InChIKeyHHFKNZMOAHJDNY-UHFFFAOYSA-N
MW406.51 g/mol
LogP1.48
Rot. Bonds5

About 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide

4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide (PubChem CID 33387816) has the molecular formula C19H26N4O4S and a molecular weight of 406.51 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide
PubChem CID33387816
Molecular FormulaC19H26N4O4S
Molecular Weight406.51 g/mol
Exact Mass406.17
IUPAC Name4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide
SMILESCOc1ccc2cc(CNC(=O)N3CCN(S(=O)(=O)N(C)C)CC3)ccc2c1
InChIInChI=1S/C19H26N4O4S/c1-21(2)28(25,26)23-10-8-22(9-11-23)19(24)20-14-15-4-5-17-13-18(27-3)7-6-16(17)12-15/h4-7,12-13H,8-11,14H2,1-3H3,(H,20,24)
InChIKeyHHFKNZMOAHJDNY-UHFFFAOYSA-N
XLogP1.48
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.51
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-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

4-[2-(dimethylamino)ethyl]-N-[(4-methoxyphenyl)methyl]piperazine-1-carboxamide
CID 113105658
N,4-bis[(4-methoxyphenyl)methyl]piperazine-1-carboxamide
CID 27516945
4-[(4-methoxyphenyl)methyl]-N-[(3-methylphenyl)methyl]piperazine-1-carboxamide
CID 113106920
(6-methoxynaphthalen-2-yl)methylcarbamic acid
CID 115170918
N-[(4-methoxyphenyl)methyl]morpholine-4-carboxamide
CID 669628
N-[[1-(dimethylsulfamoyl)piperidin-4-yl]methyl]-3-(4-methoxyphenyl)propanamide
CID 122161796
2-[(6-methoxynaphthalen-2-yl)methylamino]-1-(4-methylpiperazin-1-yl)ethanone
CID 56799660
4-[3-(3-methoxyphenyl)propanoyl]-N,N-dimethylpiperazine-1-sulfonamide
CID 32505027
4-(2-aminoethyl)-N-[(4-methoxyphenyl)methyl]piperazine-1-carboxamide
CID 108868167
4-(methanesulfonamido)-N-[(4-methoxyphenyl)methyl]piperidine-1-carboxamide
CID 53498362
N-[(3,4-dimethoxyphenyl)methyl]-4-(3-methoxyphenyl)piperazine-1-carboxamide
CID 38210733
4-benzylsulfonyl-N-[(3,5-dimethoxyphenyl)methyl]piperazine-1-carboxamide
CID 55909086

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide (CID 33387816) is 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide is COc1ccc2cc(CNC(=O)N3CCN(S(=O)(=O)N(C)C)CC3)ccc2c1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide?
The InChIKey is HHFKNZMOAHJDNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O4S/c1-21(2)28(25,26)23-10-8-22(9-11-23)19(24)20-14-15-4-5-17-13-18(27-3)7-6-16(17)12-15/h4-7,12-13H,8-11,14H2,1-3H3,(H,20,24).
What are the key properties of 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide?
4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide has a molecular weight of 406.51 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[(6-methoxynaphthalen-2-yl)methyl]piperazine-1-carboxamide is sourced from PubChem (CID 33387816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).