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

C13H16N2O2S — CID 43709570

IUPACN-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(NC1CCOc2ccccc21)C1CSCN1
InChIInChI=1S/C13H16N2O2S/c16-13(11-7-18-8-14-11)15-10-5-6-17-12-4-2-1-3-9(10)12/h1-4,10-11,14H,5-8H2,(H,15,16)
InChIKeyYOKCDFJVZDRLFE-UHFFFAOYSA-N
MW264.35 g/mol
LogP1.29
Rot. Bonds2

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

N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide (PubChem CID 43709570) has the molecular formula C13H16N2O2S and a molecular weight of 264.35 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide
PubChem CID43709570
Molecular FormulaC13H16N2O2S
Molecular Weight264.35 g/mol
Exact Mass264.09
IUPAC NameN-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(NC1CCOc2ccccc21)C1CSCN1
InChIInChI=1S/C13H16N2O2S/c16-13(11-7-18-8-14-11)15-10-5-6-17-12-4-2-1-3-9(10)12/h1-4,10-11,14H,5-8H2,(H,15,16)
InChIKeyYOKCDFJVZDRLFE-UHFFFAOYSA-N
XLogP1.29
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide
CID 119301900
(2S)-N-(3,4-dihydro-2H-chromen-4-yl)piperidine-2-carboxamide;hydrochloride
CID 119685148
N-(3,4-dihydro-2H-chromen-4-yl)-N-methyl-1,3-thiazolidine-4-carboxamide
CID 110750956
N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yl-1,3-thiazolidine-4-carboxamide
CID 119341941
(8aR)-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-7-hydroxy-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine-3-carboxamide
CID 66927406
N-(3,4-dihydro-2H-chromen-4-yl)-2-methylcyclopropane-1-carboxamide
CID 16559700
N-(3,4-dihydro-2H-chromen-4-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 18136898
N-(3,4-dihydro-2H-chromen-4-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
CID 102891199
2-amino-N-(3,4-dihydro-2H-chromen-4-yl)cyclopentane-1-carboxamide
CID 64824525
(2S)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 9091701
N-(3,4-dihydro-2H-thiochromen-4-yl)thiomorpholine-3-carboxamide
CID 82906018
3-(3,4-dihydro-2H-chromen-4-ylcarbamoyl)-1,3-thiazolidine-4-carboxylic acid
CID 62365751

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide (CID 43709570) is N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide is O=C(NC1CCOc2ccccc21)C1CSCN1.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is YOKCDFJVZDRLFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2S/c16-13(11-7-18-8-14-11)15-10-5-6-17-12-4-2-1-3-9(10)12/h1-4,10-11,14H,5-8H2,(H,15,16).
What are the key properties of N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide?
N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 264.35 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-4-yl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 43709570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).