N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide

C14H11N5OS — CID 117093775

IUPACN-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide
SMILESO=C(Nc1ccccc1)c1cnc(Nc2cnccn2)s1
InChIInChI=1S/C14H11N5OS/c20-13(18-10-4-2-1-3-5-10)11-8-17-14(21-11)19-12-9-15-6-7-16-12/h1-9H,(H,18,20)(H,16,17,19)
InChIKeyDDMRNVQNAYFOAD-UHFFFAOYSA-N
MW297.34 g/mol
LogP2.93
Rot. Bonds4

About N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide

N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide (PubChem CID 117093775) has the molecular formula C14H11N5OS and a molecular weight of 297.34 g/mol. Its IUPAC name is N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide
PubChem CID117093775
Molecular FormulaC14H11N5OS
Molecular Weight297.34 g/mol
Exact Mass297.07
IUPAC NameN-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide
SMILESO=C(Nc1ccccc1)c1cnc(Nc2cnccn2)s1
InChIInChI=1S/C14H11N5OS/c20-13(18-10-4-2-1-3-5-10)11-8-17-14(21-11)19-12-9-15-6-7-16-12/h1-9H,(H,18,20)(H,16,17,19)
InChIKeyDDMRNVQNAYFOAD-UHFFFAOYSA-N
XLogP2.93
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.34
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(pyrazin-2-ylamino)-N-(3,4,5-trimethoxyphenyl)-1,3-thiazole-5-carboxamide
CID 117086063
2-(tert-butylamino)-N-phenyl-1,3-thiazole-5-carboxamide
CID 122693201
2-(pyridin-3-ylamino)-1,3-thiazole-5-carboxylic acid
CID 80570815
N-(2-phenoxyethyl)-2-(pyrimidin-4-ylamino)-1,3-thiazole-5-carboxamide
CID 117083558
2-benzamido-N-(4-bromophenyl)-1,3-thiazole-5-carboxamide
CID 123152203
N-(2-phenoxyethyl)-2-(pyridin-4-ylamino)-1,3-thiazole-5-carboxamide
CID 117089144
2-[(6-pyridin-3-yl-2-pyridinyl)amino]-N-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carboxamide
CID 169101817
(2-anilino-1,3-thiazol-5-yl)-phenylmethanone
CID 1482526
N-(4-acetamidophenyl)-2-(pyridin-3-ylmethylamino)-1,3-thiazole-5-carboxamide
CID 117085966
N-phenyl-2-(pyrazin-2-ylamino)propanamide
CID 133311086
2-[4-[(E)-2-(benzenesulfonyl)ethenyl]anilino]-N-(4-chlorophenyl)-1,3-thiazole-5-carboxamide
CID 58075136
N-(4-morpholin-4-ylphenyl)-2-(pyridin-4-ylamino)-1,3-thiazole-5-carboxamide
CID 117084517

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide?
The IUPAC name of N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide (CID 117093775) is N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide is O=C(Nc1ccccc1)c1cnc(Nc2cnccn2)s1.
What is the InChIKey of N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide?
The InChIKey is DDMRNVQNAYFOAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5OS/c20-13(18-10-4-2-1-3-5-10)11-8-17-14(21-11)19-12-9-15-6-7-16-12/h1-9H,(H,18,20)(H,16,17,19).
What are the key properties of N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide?
N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide has a molecular weight of 297.34 g/mol, XLogP of 2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-(pyrazin-2-ylamino)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 117093775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).