4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide

C16H14N4OS — CID 46512544

IUPAC4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide
SMILESCc1nc(Nc2ccccn2)sc1C(=O)Nc1ccccc1
InChIInChI=1S/C16H14N4OS/c1-11-14(15(21)19-12-7-3-2-4-8-12)22-16(18-11)20-13-9-5-6-10-17-13/h2-10H,1H3,(H,19,21)(H,17,18,20)
InChIKeySVTMRACAJNSQJC-UHFFFAOYSA-N
MW310.38 g/mol
LogP3.84
Rot. Bonds4

About 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide

4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide (PubChem CID 46512544) has the molecular formula C16H14N4OS and a molecular weight of 310.38 g/mol. Its IUPAC name is 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide
PubChem CID46512544
Molecular FormulaC16H14N4OS
Molecular Weight310.38 g/mol
Exact Mass310.09
IUPAC Name4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide
SMILESCc1nc(Nc2ccccn2)sc1C(=O)Nc1ccccc1
InChIInChI=1S/C16H14N4OS/c1-11-14(15(21)19-12-7-3-2-4-8-12)22-16(18-11)20-13-9-5-6-10-17-13/h2-10H,1H3,(H,19,21)(H,17,18,20)
InChIKeySVTMRACAJNSQJC-UHFFFAOYSA-N
XLogP3.84
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-dimethyl-N-[4-[[2-methyl-6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]phenyl]-1,3-thiazole-5-carboxamide
CID 122317031
2-(dimethylcarbamoylamino)-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
CID 110443786
N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509789
N-(4-methoxyphenyl)-4-methyl-2-[(3-methyl-2-pyridinyl)amino]-1,3-thiazole-5-carboxamide
CID 53200115
4-methyl-2-(3-methylanilino)-N-(3-methylphenyl)-1,3-thiazole-5-carboxamide
CID 53152765
2-amino-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
CID 735558
N-(4-chlorophenyl)-4-methyl-2-(phenylcarbamoylamino)-1,3-thiazole-5-carboxamide
CID 16897056
4-methyl-2-[[4-(methylamino)benzoyl]amino]-N-phenyl-1,3-thiazole-5-carboxamide
CID 144822340
bis(2-anilino-4-methyl-1,3-thiazol-5-yl)methanone
CID 87664196
4-methyl-2-[(6-methyl-2-pyridinyl)amino]-N-(pyridin-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 53200058
2-(4-chloroanilino)-N-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 53338422
2-[3-(dimethylamino)propanoylamino]-4-methyl-N-phenyl-1,3-thiazole-5-carboxamide
CID 110442436

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide (CID 46512544) is 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide is Cc1nc(Nc2ccccn2)sc1C(=O)Nc1ccccc1.
What is the InChIKey of 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide?
The InChIKey is SVTMRACAJNSQJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4OS/c1-11-14(15(21)19-12-7-3-2-4-8-12)22-16(18-11)20-13-9-5-6-10-17-13/h2-10H,1H3,(H,19,21)(H,17,18,20).
What are the key properties of 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide?
4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide has a molecular weight of 310.38 g/mol, XLogP of 3.84, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 46512544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).