N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide

C11H15N3OS — CID 114956035

IUPACN-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1ccncc1CNC(=O)C1CSCN1
InChIInChI=1S/C11H15N3OS/c1-8-2-3-12-4-9(8)5-13-11(15)10-6-16-7-14-10/h2-4,10,14H,5-7H2,1H3,(H,13,15)
InChIKeyRJVBRFGEDQUVKD-UHFFFAOYSA-N
MW237.33 g/mol
LogP0.67
Rot. Bonds3

About N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide

N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 114956035) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide
PubChem CID114956035
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC NameN-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1ccncc1CNC(=O)C1CSCN1
InChIInChI=1S/C11H15N3OS/c1-8-2-3-12-4-9(8)5-13-11(15)10-6-16-7-14-10/h2-4,10,14H,5-7H2,1H3,(H,13,15)
InChIKeyRJVBRFGEDQUVKD-UHFFFAOYSA-N
XLogP0.67
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 61021789
(4R)-N-[(2-ethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 141124535
N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 61016722
N-[(2-methoxyphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 24698551
N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110746243
N-[(4,5-dimethoxy-2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110794315
N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119299728
N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110793633
N-[(4-methyl-3-pyridinyl)methyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 114956070
N-benzyl-1,3-thiazolidine-4-carboxamide
CID 24693076
N-[(5-chloro-2-fluorophenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110794483
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 106371148

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide (CID 114956035) is N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide is Cc1ccncc1CNC(=O)C1CSCN1.
What is the InChIKey of N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is RJVBRFGEDQUVKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c1-8-2-3-12-4-9(8)5-13-11(15)10-6-16-7-14-10/h2-4,10,14H,5-7H2,1H3,(H,13,15).
What are the key properties of N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide?
N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 237.33 g/mol, XLogP of 0.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 114956035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).