N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide

C15H16N2O3S2 — CID 167682226

IUPACN-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide
SMILESCc1ccc2c(c1)CC[C@H]2NC(=O)c1csc(S(N)(=O)=O)c1
InChIInChI=1S/C15H16N2O3S2/c1-9-2-4-12-10(6-9)3-5-13(12)17-15(18)11-7-14(21-8-11)22(16,19)20/h2,4,6-8,13H,3,5H2,1H3,(H,17,18)(H2,16,19,20)/t13-/m1/s1
InChIKeyRGTVTYFOGHOEQJ-CYBMUJFWSA-N
MW336.44 g/mol
LogP2.12
Rot. Bonds3

About N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide

N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide (PubChem CID 167682226) has the molecular formula C15H16N2O3S2 and a molecular weight of 336.44 g/mol. Its IUPAC name is N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide
PubChem CID167682226
Molecular FormulaC15H16N2O3S2
Molecular Weight336.44 g/mol
Exact Mass336.06
IUPAC NameN-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide
SMILESCc1ccc2c(c1)CC[C@H]2NC(=O)c1csc(S(N)(=O)=O)c1
InChIInChI=1S/C15H16N2O3S2/c1-9-2-4-12-10(6-9)3-5-13(12)17-15(18)11-7-14(21-8-11)22(16,19)20/h2,4,6-8,13H,3,5H2,1H3,(H,17,18)(H2,16,19,20)/t13-/m1/s1
InChIKeyRGTVTYFOGHOEQJ-CYBMUJFWSA-N
XLogP2.12
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
CID 167568086
2-hydroxy-6-methoxy-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
CID 167581888
4-(2-methoxyethylsulfonyl)-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
CID 167659779
4-(2,2-difluoroethylsulfonyl)-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
CID 167535377
2-hydroxy-3-methyl-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
CID 167581886
2-amino-N-(5-methyl-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride
CID 119302154
N-[(1S,2S)-2-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide
CID 95621563
N-(5-amino-2,3-dihydro-1H-inden-1-yl)-2-hydroxy-4-methylbenzamide
CID 79723797
3-chloro-2-hydroxy-N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]benzamide
CID 167578761
5-methylsulfonyl-N-[(1R)-6-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]thiophene-2-carboxamide
CID 167594824
N-(4-ethylcyclohexyl)-5-sulfamoylthiophene-3-carboxamide
CID 61244512
N-(oxolan-3-yl)-5-sulfamoylthiophene-3-carboxamide
CID 80715507

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide?
The IUPAC name of N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide (CID 167682226) is N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide.
What is the SMILES notation for N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide?
The canonical SMILES for N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide is Cc1ccc2c(c1)CC[C@H]2NC(=O)c1csc(S(N)(=O)=O)c1.
What is the InChIKey of N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide?
The InChIKey is RGTVTYFOGHOEQJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H16N2O3S2/c1-9-2-4-12-10(6-9)3-5-13(12)17-15(18)11-7-14(21-8-11)22(16,19)20/h2,4,6-8,13H,3,5H2,1H3,(H,17,18)(H2,16,19,20)/t13-/m1/s1.
What are the key properties of N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide?
N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 2.12, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]-5-sulfamoylthiophene-3-carboxamide is sourced from PubChem (CID 167682226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).