N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide

C10H14N4OS — CID 110746243

IUPACN-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1ccc(CNC(=O)C2CSCN2)nn1
InChIInChI=1S/C10H14N4OS/c1-7-2-3-8(14-13-7)4-11-10(15)9-5-16-6-12-9/h2-3,9,12H,4-6H2,1H3,(H,11,15)
InChIKeyYMDKULXMHUVATP-UHFFFAOYSA-N
MW238.32 g/mol
LogP0.06
Rot. Bonds3

About N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide

N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 110746243) has the molecular formula C10H14N4OS and a molecular weight of 238.32 g/mol. Its IUPAC name is N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
PubChem CID110746243
Molecular FormulaC10H14N4OS
Molecular Weight238.32 g/mol
Exact Mass238.09
IUPAC NameN-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCc1ccc(CNC(=O)C2CSCN2)nn1
InChIInChI=1S/C10H14N4OS/c1-7-2-3-8(14-13-7)4-11-10(15)9-5-16-6-12-9/h2-3,9,12H,4-6H2,1H3,(H,11,15)
InChIKeyYMDKULXMHUVATP-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
CID 61016722
N-[(2-methylpyrimidin-4-yl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119299728
(4S)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 97014181
N-benzyl-1,3-thiazolidine-4-carboxamide
CID 24693076
N-[(4-methyl-3-pyridinyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 114956035
N-[(2,4,6-trimethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110793633
(4R)-N-[(2-ethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 141124535
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 61021789
N-[(5-methylpyrazin-2-yl)methyl]thiomorpholine-3-carboxamide
CID 82908850
N-[(4-propylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 110793540
N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 61004222
N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 103813840

Frequently Asked Questions

What is the IUPAC name of N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide (CID 110746243) is N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide is Cc1ccc(CNC(=O)C2CSCN2)nn1.
What is the InChIKey of N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is YMDKULXMHUVATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4OS/c1-7-2-3-8(14-13-7)4-11-10(15)9-5-16-6-12-9/h2-3,9,12H,4-6H2,1H3,(H,11,15).
What are the key properties of N-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide?
N-[(6-methylpyridazin-3-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-[(6-methylpyridazin-3-yl)methyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 110746243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).