N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide

C10H14N4OS — CID 61016722

IUPACN-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1nccc(CNC(=O)C2CSCN2)n1
InChIInChI=1S/C10H14N4OS/c1-7-11-3-2-8(14-7)4-12-10(15)9-5-16-6-13-9/h2-3,9,13H,4-6H2,1H3,(H,12,15)
InChIKeyLFVQYSFYFBRUMY-UHFFFAOYSA-N
MW238.32 g/mol
LogP0.06
Rot. Bonds3

About N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide

N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 61016722) has the molecular formula C10H14N4OS and a molecular weight of 238.32 g/mol. Its IUPAC name is N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
PubChem CID61016722
Molecular FormulaC10H14N4OS
Molecular Weight238.32 g/mol
Exact Mass238.09
IUPAC NameN-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1nccc(CNC(=O)C2CSCN2)n1
InChIInChI=1S/C10H14N4OS/c1-7-11-3-2-8(14-7)4-12-10(15)9-5-16-6-13-9/h2-3,9,13H,4-6H2,1H3,(H,12,15)
InChIKeyLFVQYSFYFBRUMY-UHFFFAOYSA-N
XLogP0.06
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.32
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119299728
N-[(2-methylpyrimidin-4-yl)methyl]thiomorpholine-3-carboxamide
CID 82908468
N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110746243
(3R)-N-[(2-methylpyrimidin-4-yl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 61165563
N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 114956035
N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 61015389
N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110742446
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 119891916
N-benzyl-1,3-thiazolidine-4-carboxamide
CID 24693076
N-[(2-methylpyrimidin-4-yl)methyl]-2-thiomorpholin-3-ylacetamide
CID 66422864
(2R,3S)-2-methyl-N-[(2-methylpyrimidin-4-yl)methyl]morpholine-3-carboxamide
CID 120926840
(4R)-N-[(2-ethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 141124535

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide (CID 61016722) is N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide is Cc1nccc(CNC(=O)C2CSCN2)n1.
What is the InChIKey of N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is LFVQYSFYFBRUMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4OS/c1-7-11-3-2-8(14-7)4-12-10(15)9-5-16-6-13-9/h2-3,9,13H,4-6H2,1H3,(H,12,15).
What are the key properties of N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide?
N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 238.32 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 61016722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).