N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide

C13H16N2OS — CID 24706047

IUPACN-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1ccc2c(c1)CCC2)C1CSCN1
InChIInChI=1S/C13H16N2OS/c16-13(12-7-17-8-14-12)15-11-5-4-9-2-1-3-10(9)6-11/h4-6,12,14H,1-3,7-8H2,(H,15,16)
InChIKeyUZFRHRCNTNLTQC-UHFFFAOYSA-N
MW248.35 g/mol
LogP1.78
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide

N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide (PubChem CID 24706047) has the molecular formula C13H16N2OS and a molecular weight of 248.35 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide
PubChem CID24706047
Molecular FormulaC13H16N2OS
Molecular Weight248.35 g/mol
Exact Mass248.10
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1ccc2c(c1)CCC2)C1CSCN1
InChIInChI=1S/C13H16N2OS/c16-13(12-7-17-8-14-12)15-11-5-4-9-2-1-3-10(9)6-11/h4-6,12,14H,1-3,7-8H2,(H,15,16)
InChIKeyUZFRHRCNTNLTQC-UHFFFAOYSA-N
XLogP1.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dimethylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 50988129
N-(3,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119263074
N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide
CID 24692510
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazolidine-4-carboxamide
CID 24698635
N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide
CID 54862020
N-(3-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24689839
N-(4-tert-butylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24691196
N-(4-carbamoyl-3-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119318629
(4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119326722
N-(4-methoxyphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 47003209
N-(3-ethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24703459
N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119832878

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide (CID 24706047) is N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide is O=C(Nc1ccc2c(c1)CCC2)C1CSCN1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is UZFRHRCNTNLTQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2OS/c16-13(12-7-17-8-14-12)15-11-5-4-9-2-1-3-10(9)6-11/h4-6,12,14H,1-3,7-8H2,(H,15,16).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide?
N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 248.35 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 24706047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).