methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate

C10H11N5O2 — CID 103772189

IUPACmethyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate
SMILESCOC(=O)c1cnc(Nc2cnn(C)c2)cn1
InChIInChI=1S/C10H11N5O2/c1-15-6-7(3-13-15)14-9-5-11-8(4-12-9)10(16)17-2/h3-6H,1-2H3,(H,12,14)
InChIKeyKMXKYHJCAOWDQT-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.74
Rot. Bonds3

About methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate

methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate (PubChem CID 103772189) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate.

Molecular Properties

Compound Namemethyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate
PubChem CID103772189
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC Namemethyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate
SMILESCOC(=O)c1cnc(Nc2cnn(C)c2)cn1
InChIInChI=1S/C10H11N5O2/c1-15-6-7(3-13-15)14-9-5-11-8(4-12-9)10(16)17-2/h3-6H,1-2H3,(H,12,14)
InChIKeyKMXKYHJCAOWDQT-UHFFFAOYSA-N
XLogP0.74
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-[(1-methylpyrazol-4-yl)amino]pyridazine-3-carboxylic acid
CID 60792259
5-chloro-2-[(1-methylpyrazol-4-yl)amino]pyridine-4-carboxylic acid
CID 114919233
methyl 4-[[5-[methyl(phenyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109290259
methyl 5-(2-fluoro-4-methylanilino)pyrazine-2-carboxylate
CID 114059713
methyl 4-[[5-(propan-2-ylcarbamoyl)pyrazin-2-yl]amino]benzoate
CID 109271303
methyl 5-(2-cyanoanilino)pyrazine-2-carboxylate
CID 114059701
methyl 5-(butylamino)pyrazine-2-carboxylate
CID 68565370
methyl 5-(piperidin-4-ylamino)pyrazine-2-carboxylate;hydrochloride
CID 172829952
methyl 2,5-dimethyl-4-[(1-methylpyrazol-4-yl)amino]thieno[2,3-d]pyrimidine-6-carboxylate
CID 47054742
methyl 5-[(3-methoxycyclopentyl)amino]pyrazine-2-carboxylate
CID 114118099
4-bromo-3,5-dimethoxy-N-(1-methylpyrazol-4-yl)benzamide
CID 32606056
5-bromo-6-[(1-methylpyrazol-4-yl)amino]pyridine-3-carboxylic acid
CID 167950874

Frequently Asked Questions

What is the IUPAC name of methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate?
The IUPAC name of methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate (CID 103772189) is methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate.
What is the SMILES notation for methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate?
The canonical SMILES for methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate is COC(=O)c1cnc(Nc2cnn(C)c2)cn1.
What is the InChIKey of methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate?
The InChIKey is KMXKYHJCAOWDQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c1-15-6-7(3-13-15)14-9-5-11-8(4-12-9)10(16)17-2/h3-6H,1-2H3,(H,12,14).
What are the key properties of methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate?
methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate has a molecular weight of 233.23 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-[(1-methylpyrazol-4-yl)amino]pyrazine-2-carboxylate is sourced from PubChem (CID 103772189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).