2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide

C8H6N4OS — CID 140663023

IUPAC2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide
SMILESNC(=O)c1cnc(-c2ncccn2)s1
InChIInChI=1S/C8H6N4OS/c9-6(13)5-4-12-8(14-5)7-10-2-1-3-11-7/h1-4H,(H2,9,13)
InChIKeyFAINGELZAQKRKO-UHFFFAOYSA-N
MW206.23 g/mol
LogP0.70
Rot. Bonds2

About 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide

2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide (PubChem CID 140663023) has the molecular formula C8H6N4OS and a molecular weight of 206.23 g/mol. Its IUPAC name is 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide
PubChem CID140663023
Molecular FormulaC8H6N4OS
Molecular Weight206.23 g/mol
Exact Mass206.03
IUPAC Name2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide
SMILESNC(=O)c1cnc(-c2ncccn2)s1
InChIInChI=1S/C8H6N4OS/c9-6(13)5-4-12-8(14-5)7-10-2-1-3-11-7/h1-4H,(H2,9,13)
InChIKeyFAINGELZAQKRKO-UHFFFAOYSA-N
XLogP0.70
TPSA81.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.23
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3-thiazol-4-yl)pyrimidine-5-carboxamide
CID 137644853
2-(Pyrimidin-2-yl)-1,3-thiazole-5-carboxylic acid
CID 43622195
3-(Pyrimidin-2-ylamino)-1-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propan-1-one
CID 45822006
4-chloro-N-[2-(pyrimidin-2-ylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 47369952
2-tert-butyl-N-[2-(pyrimidin-2-ylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 47886341
3-(Pyrimidin-2-ylamino)-1-[4-(1,3-thiazol-2-yl)-1,4-diazepan-1-yl]propan-1-one
CID 48504780
2-methyl-N-[2-(pyrimidin-2-ylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 53547436
N-(1,3-thiazol-2-yl)pyrimidine-5-carboxamide
CID 110466780
2-ethyl-N-[2-(pyrimidin-2-ylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 47427175
N-[[1-(2-methylpropyl)cyclopropyl]methyl]-2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide
CID 75425823
2-pyrimidin-2-yl-N-[2-(2H-tetrazol-5-yl)propan-2-yl]-1,3-thiazole-5-carboxamide
CID 132306657
(3S)-N-ethyl-1-(2-pyrimidin-2-yl-1,3-thiazole-5-carbonyl)pyrrolidine-3-sulfonamide
CID 164629802

Frequently Asked Questions

What is the IUPAC name of 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide (CID 140663023) is 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide is NC(=O)c1cnc(-c2ncccn2)s1.
What is the InChIKey of 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide?
The InChIKey is FAINGELZAQKRKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N4OS/c9-6(13)5-4-12-8(14-5)7-10-2-1-3-11-7/h1-4H,(H2,9,13).
What are the key properties of 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide?
2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide has a molecular weight of 206.23 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrimidin-2-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 140663023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).