N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide

C10H9N3OS — CID 31303207

IUPACN-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide
SMILESCn1ccs/c1=N/C(=O)c1ccncc1
InChIInChI=1S/C10H9N3OS/c1-13-6-7-15-10(13)12-9(14)8-2-4-11-5-3-8/h2-7H,1H3/b12-10+
InChIKeyNABWKZFWXRKFKW-ZRDIBKRKSA-N
MW219.27 g/mol
LogP1.22
Rot. Bonds1

About N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide

N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide (PubChem CID 31303207) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide
PubChem CID31303207
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC NameN-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide
SMILESCn1ccs/c1=N/C(=O)c1ccncc1
InChIInChI=1S/C10H9N3OS/c1-13-6-7-15-10(13)12-9(14)8-2-4-11-5-3-8/h2-7H,1H3/b12-10+
InChIKeyNABWKZFWXRKFKW-ZRDIBKRKSA-N
XLogP1.22
TPSA47.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
CID 38163110
N-(3-methyl-1,3-thiazol-2-ylidene)-1-oxidopyridin-1-ium-4-carboxamide
CID 38163154
4-[(S)-methylsulfinyl]-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
CID 95148026
4-(difluoromethylsulfonyl)-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
CID 9119081
N-(3-methyl-1,3-thiazol-2-ylidene)-4-(pyrrolidin-1-ylmethyl)benzamide
CID 71899527
3-(dimethylamino)-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
CID 31289913
N-[3-[(3-methyl-1,3-thiazol-2-ylidene)carbamoyl]phenyl]thiophene-2-carboxamide
CID 39964667
3,5-dimethoxy-4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)benzamide
CID 38162531
4-imidazol-1-yl-N-(3-methyl-1,3-thiazol-2-ylidene)-3-nitrobenzamide
CID 51146735
N-(3-methyl-1,3-thiazol-2-ylidene)-6-oxo-1H-pyridazine-3-carboxamide
CID 30660624
4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)-3,5-dinitrobenzamide
CID 38163157
6-(4-bromophenoxy)-N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-3-carboxamide
CID 52649954

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide?
The IUPAC name of N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide (CID 31303207) is N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide.
What is the SMILES notation for N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide?
The canonical SMILES for N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide is Cn1ccs/c1=N/C(=O)c1ccncc1.
What is the InChIKey of N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide?
The InChIKey is NABWKZFWXRKFKW-ZRDIBKRKSA-N. The full InChI is InChI=1S/C10H9N3OS/c1-13-6-7-15-10(13)12-9(14)8-2-4-11-5-3-8/h2-7H,1H3/b12-10+.
What are the key properties of N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide?
N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide has a molecular weight of 219.27 g/mol, XLogP of 1.22, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-1,3-thiazol-2-ylidene)pyridine-4-carboxamide is sourced from PubChem (CID 31303207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).