4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide

C9H10N4OS — CID 43641889

IUPAC4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide
SMILESCn1cc(N)cc1C(=O)Nc1nccs1
InChIInChI=1S/C9H10N4OS/c1-13-5-6(10)4-7(13)8(14)12-9-11-2-3-15-9/h2-5H,10H2,1H3,(H,11,12,14)
InChIKeyCGQWEYYLSOSECX-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.32
Rot. Bonds2

About 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide

4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide (PubChem CID 43641889) has the molecular formula C9H10N4OS and a molecular weight of 222.27 g/mol. Its IUPAC name is 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide
PubChem CID43641889
Molecular FormulaC9H10N4OS
Molecular Weight222.27 g/mol
Exact Mass222.06
IUPAC Name4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide
SMILESCn1cc(N)cc1C(=O)Nc1nccs1
InChIInChI=1S/C9H10N4OS/c1-13-5-6(10)4-7(13)8(14)12-9-11-2-3-15-9/h2-5H,10H2,1H3,(H,11,12,14)
InChIKeyCGQWEYYLSOSECX-UHFFFAOYSA-N
XLogP1.32
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-1-propan-2-yl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide
CID 43641885
1-methyl-4-(methylsulfamoyl)-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide
CID 36916717
1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide
CID 2999793
4-amino-1-methyl-N-pyrazin-2-ylpyrrole-2-carboxamide
CID 43644131
4-amino-1-methyl-N-pyrimidin-5-ylpyrrole-2-carboxamide
CID 107587408
3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 61090146
3-(4-fluorophenyl)-1-methyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide
CID 121083918
3-amino-4-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 16771043
4-amino-N-(4,6-dimethyl-2-pyridinyl)-1-methylpyrrole-2-carboxamide
CID 114931717
1,3-dimethyl-2,4-dioxo-N-(1,3-thiazol-2-yl)pyrimidine-5-carboxamide
CID 84560983
1-methyl-N-(1,3-thiazol-2-yl)-3,4-dihydro-2H-quinoline-6-carboxamide
CID 110485892
methyl 4-[[4-[[4-[(4-amino-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxylate
CID 147658735

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide?
The IUPAC name of 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide (CID 43641889) is 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide is Cn1cc(N)cc1C(=O)Nc1nccs1.
What is the InChIKey of 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide?
The InChIKey is CGQWEYYLSOSECX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4OS/c1-13-5-6(10)4-7(13)8(14)12-9-11-2-3-15-9/h2-5H,10H2,1H3,(H,11,12,14).
What are the key properties of 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide?
4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide has a molecular weight of 222.27 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-methyl-N-(1,3-thiazol-2-yl)pyrrole-2-carboxamide is sourced from PubChem (CID 43641889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).