lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide

C14H14LiNO3S — CID 173095463

IUPAClithium;hydride;N-(4-methylphenyl)sulfonylbenzamide
SMILESCc1ccc(S(=O)(=O)NC(=O)c2ccccc2)cc1.[H-].[Li+]
InChIInChI=1S/C14H13NO3S.Li.H/c1-11-7-9-13(10-8-11)19(17,18)15-14(16)12-5-3-2-4-6-12;;/h2-10H,1H3,(H,15,16);;/q;+1;-1
InChIKeyCMCMERMXBCJWPK-UHFFFAOYSA-N
MW283.28 g/mol
LogP-0.77
Rot. Bonds3

About lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide

lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide (PubChem CID 173095463) has the molecular formula C14H14LiNO3S and a molecular weight of 283.28 g/mol. Its IUPAC name is lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide.

Molecular Properties

Compound Namelithium;hydride;N-(4-methylphenyl)sulfonylbenzamide
PubChem CID173095463
Molecular FormulaC14H14LiNO3S
Molecular Weight283.28 g/mol
Exact Mass283.09
IUPAC Namelithium;hydride;N-(4-methylphenyl)sulfonylbenzamide
SMILESCc1ccc(S(=O)(=O)NC(=O)c2ccccc2)cc1.[H-].[Li+]
InChIInChI=1S/C14H13NO3S.Li.H/c1-11-7-9-13(10-8-11)19(17,18)15-14(16)12-5-3-2-4-6-12;;/h2-10H,1H3,(H,15,16);;/q;+1;-1
InChIKeyCMCMERMXBCJWPK-UHFFFAOYSA-N
XLogP-0.77
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.28
LogP ≤ 5-0.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzamido-3-(4-methylphenyl)sulfonylurea
CID 4142958
4-methyl-N-(1-phenylethenyl)benzenesulfonamide
CID 11471299
N-(4-chlorophenyl)sulfonyl-4-(4-methylphenyl)benzamide
CID 56655954
N-(benzenesulfonyl)-N'-(4-methylphenyl)sulfonylpropanediamide
CID 135051885
4-N-(benzenesulfonyl)-1-N-methylbenzene-1,4-dicarboxamide
CID 90126567
N-[4-[(3-methylphenyl)carbamoylamino]phenyl]sulfonylbenzamide
CID 22921487
N'-dichlorophosphoryl-N-(4-methylphenyl)sulfonylbenzenecarboximidamide
CID 3514861
4-amino-N-(benzenesulfonyl)benzamide
CID 12876556
N-(benzenesulfonyl)-4-chlorobenzamide
CID 2355220
N-[7-(benzoylsulfamoyl)-9-oxofluoren-2-yl]sulfonylbenzamide
CID 2294379
3-methyl-N-[4-[(4-methylphenyl)carbamothioylamino]phenyl]sulfonylbenzamide
CID 22921504
4-methyl-N-[4-[(3-methylphenyl)carbamoylamino]phenyl]sulfonylbenzamide
CID 22441702

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide?
The IUPAC name of lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide (CID 173095463) is lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide.
What is the SMILES notation for lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide?
The canonical SMILES for lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide is Cc1ccc(S(=O)(=O)NC(=O)c2ccccc2)cc1.[H-].[Li+].
What is the InChIKey of lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide?
The InChIKey is CMCMERMXBCJWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO3S.Li.H/c1-11-7-9-13(10-8-11)19(17,18)15-14(16)12-5-3-2-4-6-12;;/h2-10H,1H3,(H,15,16);;/q;+1;-1.
What are the key properties of lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide?
lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide has a molecular weight of 283.28 g/mol, XLogP of -0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;N-(4-methylphenyl)sulfonylbenzamide is sourced from PubChem (CID 173095463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).