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

C18H19NO2S — CID 97147711

IUPACN-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide
SMILESO=C(NC1Cc2ccccc2C1)c1ccc([C@H]2CCCO2)s1
InChIInChI=1S/C18H19NO2S/c20-18(17-8-7-16(22-17)15-6-3-9-21-15)19-14-10-12-4-1-2-5-13(12)11-14/h1-2,4-5,7-8,14-15H,3,6,9-11H2,(H,19,20)/t15-/m1/s1
InChIKeyBHVORKVJVSNBAF-OAHLLOKOSA-N
MW313.42 g/mol
LogP3.50
Rot. Bonds3

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

N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide (PubChem CID 97147711) has the molecular formula C18H19NO2S and a molecular weight of 313.42 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide
PubChem CID97147711
Molecular FormulaC18H19NO2S
Molecular Weight313.42 g/mol
Exact Mass313.11
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide
SMILESO=C(NC1Cc2ccccc2C1)c1ccc([C@H]2CCCO2)s1
InChIInChI=1S/C18H19NO2S/c20-18(17-8-7-16(22-17)15-6-3-9-21-15)19-14-10-12-4-1-2-5-13(12)11-14/h1-2,4-5,7-8,14-15H,3,6,9-11H2,(H,19,20)/t15-/m1/s1
InChIKeyBHVORKVJVSNBAF-OAHLLOKOSA-N
XLogP3.50
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[2-(cyclopropylamino)-2-oxoethyl]phenyl]-5-(oxolan-2-yl)thiophene-2-carboxamide
CID 131889426
N-[1-(6-chloropyridazin-3-yl)piperidin-4-yl]-5-[(2S)-oxolan-2-yl]thiophene-2-carboxamide
CID 97151424
N-[1-(6-chloropyridazin-3-yl)piperidin-4-yl]-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide
CID 97151425
N-[2-[[5-[(2S)-oxolan-2-yl]thiophene-2-carbonyl]amino]ethyl]pyridine-3-carboxamide
CID 97141444
5-(oxolan-2-yl)-N-(2-pyrrolidin-1-ylsulfonylethyl)thiophene-2-carboxamide
CID 72923589
N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-2-yl]thiophene-2-carboxamide
CID 31104740
N-(2,3-dihydro-1H-inden-2-yl)benzamide
CID 2823441
N-[2-(5-methylfuran-2-yl)ethyl]-5-(oxolan-2-yl)thiophene-2-carboxamide
CID 72886191
N-[(3,4-difluorophenyl)methyl]-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide
CID 97141233
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-5-(oxolan-2-yl)thiophene-2-carboxamide
CID 72902804
5-[(2-phenyloxan-4-yl)carbamoyl]thiophene-2-carboxylic acid
CID 120699083
N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]-5-(oxolan-2-yl)thiophene-2-carboxamide
CID 56744091

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide (CID 97147711) is N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide is O=C(NC1Cc2ccccc2C1)c1ccc([C@H]2CCCO2)s1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide?
The InChIKey is BHVORKVJVSNBAF-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H19NO2S/c20-18(17-8-7-16(22-17)15-6-3-9-21-15)19-14-10-12-4-1-2-5-13(12)11-14/h1-2,4-5,7-8,14-15H,3,6,9-11H2,(H,19,20)/t15-/m1/s1.
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide?
N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide has a molecular weight of 313.42 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-5-[(2R)-oxolan-2-yl]thiophene-2-carboxamide is sourced from PubChem (CID 97147711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).