3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide

C12H12N6O — CID 136525921

IUPAC3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide
SMILESNc1nccnc1C(=O)Nc1cnc(C2CC2)nc1
InChIInChI=1S/C12H12N6O/c13-10-9(14-3-4-15-10)12(19)18-8-5-16-11(17-6-8)7-1-2-7/h3-7H,1-2H2,(H2,13,15)(H,18,19)
InChIKeyFDUWDQGHMNGUKG-UHFFFAOYSA-N
MW256.27 g/mol
LogP0.98
Rot. Bonds3

About 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide

3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide (PubChem CID 136525921) has the molecular formula C12H12N6O and a molecular weight of 256.27 g/mol. Its IUPAC name is 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide
PubChem CID136525921
Molecular FormulaC12H12N6O
Molecular Weight256.27 g/mol
Exact Mass256.11
IUPAC Name3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide
SMILESNc1nccnc1C(=O)Nc1cnc(C2CC2)nc1
InChIInChI=1S/C12H12N6O/c13-10-9(14-3-4-15-10)12(19)18-8-5-16-11(17-6-8)7-1-2-7/h3-7H,1-2H2,(H2,13,15)(H,18,19)
InChIKeyFDUWDQGHMNGUKG-UHFFFAOYSA-N
XLogP0.98
TPSA106.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-N-(4-iodophenyl)pyrazine-2-carboxamide
CID 46525550
3-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazine-2-carboxamide
CID 30136975
1-cyclopropyl-3-(2-cyclopropylpyrimidin-5-yl)urea
CID 71933502
3-amino-N'-(cyclopropanecarbonyl)pyrazine-2-carbohydrazide
CID 36706406
3-amino-N-(4-pyrrolidin-1-ylphenyl)pyrazine-2-carboxamide
CID 42393792
N-(2-cyclopropylpyrimidin-5-yl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 167766294
3-amino-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 46673484
N-(2-cyclopropylpyrimidin-5-yl)-2-hydroxycyclopentane-1-carboxamide
CID 110014513
3-amino-N-(cyclobutylmethyl)pyrazine-2-carboxamide
CID 38654065
3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide
CID 119132594
3-amino-N-(4-aminocyclohexyl)pyrazine-2-carboxamide;dihydrochloride
CID 119474422
3-amino-N-[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]pyrazine-2-carboxamide
CID 30831505

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide (CID 136525921) is 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide is Nc1nccnc1C(=O)Nc1cnc(C2CC2)nc1.
What is the InChIKey of 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide?
The InChIKey is FDUWDQGHMNGUKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N6O/c13-10-9(14-3-4-15-10)12(19)18-8-5-16-11(17-6-8)7-1-2-7/h3-7H,1-2H2,(H2,13,15)(H,18,19).
What are the key properties of 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide?
3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide has a molecular weight of 256.27 g/mol, XLogP of 0.98, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-cyclopropylpyrimidin-5-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 136525921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).