N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide

C11H11N3OS — CID 110746418

IUPACN-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide
SMILESCc1cnc(CNC(=O)c2ccccn2)s1
InChIInChI=1S/C11H11N3OS/c1-8-6-13-10(16-8)7-14-11(15)9-4-2-3-5-12-9/h2-6H,7H2,1H3,(H,14,15)
InChIKeyXKCADHGNDVNYOR-UHFFFAOYSA-N
MW233.30 g/mol
LogP1.78
Rot. Bonds3

About N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide

N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide (PubChem CID 110746418) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide
PubChem CID110746418
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC NameN-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide
SMILESCc1cnc(CNC(=O)c2ccccn2)s1
InChIInChI=1S/C11H11N3OS/c1-8-6-13-10(16-8)7-14-11(15)9-4-2-3-5-12-9/h2-6H,7H2,1H3,(H,14,15)
InChIKeyXKCADHGNDVNYOR-UHFFFAOYSA-N
XLogP1.78
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrazine-2-carboxamide
CID 110746419
6-[(5-methyl-1,3-thiazol-2-yl)methylcarbamoyl]pyridine-3-carboxylic acid
CID 106704146
1-chloro-N-[(5-methyl-1,3-thiazol-2-yl)methyl]isoquinoline-3-carboxamide
CID 103822717
5-chloro-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyrazine-2-carboxamide
CID 107257898
2-amino-N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-3-carboxamide
CID 82546789
4-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]benzamide
CID 110738921
1-N-methyl-3-N-[(5-methyl-1,3-thiazol-2-yl)methyl]benzene-1,3-dicarboxamide
CID 68670537
2-(1H-indol-3-yl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]acetamide
CID 110746414
(5-methyl-1,3-thiazol-2-yl)methylurea
CID 103708250
N-benzyl-4-[2-(5-methyl-1,3-thiazol-2-yl)ethylamino]pyridine-2-carboxamide
CID 133323217
1-methoxy-3-[(5-methyl-1,3-thiazol-2-yl)methyl]urea
CID 130678537
N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-[(1S)-1-pyridin-2-ylethyl]piperazine-1-carboxamide
CID 97308542

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide (CID 110746418) is N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide is Cc1cnc(CNC(=O)c2ccccn2)s1.
What is the InChIKey of N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide?
The InChIKey is XKCADHGNDVNYOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3OS/c1-8-6-13-10(16-8)7-14-11(15)9-4-2-3-5-12-9/h2-6H,7H2,1H3,(H,14,15).
What are the key properties of N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide?
N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide has a molecular weight of 233.30 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 110746418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).