5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride

C14H25ClN4O4S — CID 119449323

IUPAC5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride
SMILESCc1oc(S(=O)(=O)N(C)C)cc1C(=O)NCCN1CCNCC1.Cl
InChIInChI=1S/C14H24N4O4S.ClH/c1-11-12(10-13(22-11)23(20,21)17(2)3)14(19)16-6-9-18-7-4-15-5-8-18;/h10,15H,4-9H2,1-3H3,(H,16,19);1H
InChIKeyPMUYJWQQKIOELT-UHFFFAOYSA-N
MW380.90 g/mol
LogP-0.10
Rot. Bonds6

About 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride

5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride (PubChem CID 119449323) has the molecular formula C14H25ClN4O4S and a molecular weight of 380.90 g/mol. Its IUPAC name is 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride
PubChem CID119449323
Molecular FormulaC14H25ClN4O4S
Molecular Weight380.90 g/mol
Exact Mass380.13
IUPAC Name5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride
SMILESCc1oc(S(=O)(=O)N(C)C)cc1C(=O)NCCN1CCNCC1.Cl
InChIInChI=1S/C14H24N4O4S.ClH/c1-11-12(10-13(22-11)23(20,21)17(2)3)14(19)16-6-9-18-7-4-15-5-8-18;/h10,15H,4-9H2,1-3H3,(H,16,19);1H
InChIKeyPMUYJWQQKIOELT-UHFFFAOYSA-N
XLogP-0.10
TPSA94.89 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.90
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(dimethylsulfamoyl)-2-methyl-N-[3-(methylamino)propyl]furan-3-carboxamide
CID 119434335
methyl 2-methyl-5-(3-piperazin-1-ylpropylsulfamoyl)furan-3-carboxylate
CID 119994394
2-methyl-N-(2-piperazin-1-ylethyl)-5-sulfanylbenzamide
CID 107024052
2-chloro-4-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 106862040
3-(dimethylsulfamoyl)-N-(3-piperazin-1-ylpropyl)thiophene-2-carboxamide;hydrochloride
CID 119392093
2,5-dimethyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide;hydrochloride
CID 119447776
5-ethyl-4-methyl-N-(2-piperazin-1-ylethyl)furan-2-carboxamide
CID 119446544
4-methyl-3-methylsulfonyl-N-(2-piperazin-1-ylethyl)benzamide
CID 119446273
2,5-dimethyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide
CID 66127121
4-chloro-2-fluoro-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119445404
3-methyl-N-(3-piperazin-1-ylpropyl)-1,2-oxazole-5-carboxamide;hydrochloride
CID 119394236
3-chloro-4-iodo-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119448751

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride?
The IUPAC name of 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride (CID 119449323) is 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride.
What is the SMILES notation for 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride?
The canonical SMILES for 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride is Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NCCN1CCNCC1.Cl.
What is the InChIKey of 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride?
The InChIKey is PMUYJWQQKIOELT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O4S.ClH/c1-11-12(10-13(22-11)23(20,21)17(2)3)14(19)16-6-9-18-7-4-15-5-8-18;/h10,15H,4-9H2,1-3H3,(H,16,19);1H.
What are the key properties of 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride?
5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride has a molecular weight of 380.90 g/mol, XLogP of -0.10, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoyl)-2-methyl-N-(2-piperazin-1-ylethyl)furan-3-carboxamide;hydrochloride is sourced from PubChem (CID 119449323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).