N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide

C13H15N3O2S — CID 169090978

IUPACN-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide
SMILESCc1cncc(C(=O)Nc2nc(C)c(CCO)s2)c1
InChIInChI=1S/C13H15N3O2S/c1-8-5-10(7-14-6-8)12(18)16-13-15-9(2)11(19-13)3-4-17/h5-7,17H,3-4H2,1-2H3,(H,15,16,18)
InChIKeyZMZTWKPMRDFSEY-UHFFFAOYSA-N
MW277.35 g/mol
LogP1.94
Rot. Bonds4

About N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide

N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide (PubChem CID 169090978) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide
PubChem CID169090978
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC NameN-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide
SMILESCc1cncc(C(=O)Nc2nc(C)c(CCO)s2)c1
InChIInChI=1S/C13H15N3O2S/c1-8-5-10(7-14-6-8)12(18)16-13-15-9(2)11(19-13)3-4-17/h5-7,17H,3-4H2,1-2H3,(H,15,16,18)
InChIKeyZMZTWKPMRDFSEY-UHFFFAOYSA-N
XLogP1.94
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(hydroxyamino)-4-methyl-1,3-thiazol-5-yl]ethanol
CID 143129524
3-(2-benzamido-4-methyl-1,3-thiazol-5-yl)propanoic acid
CID 82058794
2-[4-methyl-2-[(3-methylbenzoyl)amino]-1,3-thiazol-5-yl]acetic acid
CID 82058766
ethyl 2-[(5-bromopyridine-3-carbonyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
CID 1126047
5-methyl-N-(4-methylphenyl)pyridine-3-carboxamide
CID 143173797
2-(2-benzamido-4-methyl-1,3-thiazol-5-yl)acetic acid
CID 82058764
N-(5-benzyl-4-methyl-1,3-thiazol-2-yl)-4-methylbenzamide
CID 43837130
1-(5-ethyl-4-methyl-1,3-thiazol-2-yl)-3-[5-(2-hydroxyethyl)-4-methylthiophen-2-yl]sulfonylurea
CID 42633650
N-(3,5-dichlorophenyl)-5-methylpyridine-3-carboxamide
CID 143700451
bis(formonitrile);N-(6-methanehydrazonoyl-1,3-benzothiazol-2-yl)-5-methylpyridine-3-carboxamide
CID 154945782
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-5-methylpyridine-3-carboxamide
CID 104629967
4-chloro-N-[5-[(4-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]benzamide
CID 43836537

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide?
The IUPAC name of N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide (CID 169090978) is N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide.
What is the SMILES notation for N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide?
The canonical SMILES for N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide is Cc1cncc(C(=O)Nc2nc(C)c(CCO)s2)c1.
What is the InChIKey of N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide?
The InChIKey is ZMZTWKPMRDFSEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c1-8-5-10(7-14-6-8)12(18)16-13-15-9(2)11(19-13)3-4-17/h5-7,17H,3-4H2,1-2H3,(H,15,16,18).
What are the key properties of N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide?
N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide has a molecular weight of 277.35 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-2-yl]-5-methylpyridine-3-carboxamide is sourced from PubChem (CID 169090978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).