3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine

C10H13N3 — CID 168797976

IUPAC3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine
SMILESCc1nc2[nH]ccc2nc1C(C)C
InChIInChI=1S/C10H13N3/c1-6(2)9-7(3)12-10-8(13-9)4-5-11-10/h4-6H,1-3H3,(H,11,12)
InChIKeySDIYRNKDNBVFOA-UHFFFAOYSA-N
MW175.24 g/mol
LogP2.39
Rot. Bonds1

About 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine

3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 168797976) has the molecular formula C10H13N3 and a molecular weight of 175.24 g/mol. Its IUPAC name is 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine
PubChem CID168797976
Molecular FormulaC10H13N3
Molecular Weight175.24 g/mol
Exact Mass175.11
IUPAC Name3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine
SMILESCc1nc2[nH]ccc2nc1C(C)C
InChIInChI=1S/C10H13N3/c1-6(2)9-7(3)12-10-8(13-9)4-5-11-10/h4-6H,1-3H3,(H,11,12)
InChIKeySDIYRNKDNBVFOA-UHFFFAOYSA-N
XLogP2.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.24
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-3-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine
CID 145283864
3-methyl-2-phenyl-5H-pyrrolo[2,3-b]pyrazine
CID 22294675
6-fluoro-3-methyl-2-propan-2-ylquinoxaline
CID 90949663
2,2,2-trifluoro-1-[3-(3-methylphenyl)sulfonyl-5H-pyrrolo[2,3-b]pyrazin-2-yl]ethanamine;hydrochloride
CID 141383368
2-(4-methylphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 150329888
2-methyl-1-(1H-pyrrolo[2,3-b]pyridin-6-yl)propan-1-one
CID 71743078
3,5-dimethyl-2-propan-2-ylquinoxaline;ethane;prop-1-ene
CID 145415743
6-propan-2-yl-2H-pyrido[4,3-c][1,6]naphthyridin-1-one
CID 67416123
2-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine
CID 54126427
3-propan-2-yl-7H-pyrrolo[2,3-c]pyridazine
CID 122697373
methyl 3-amino-5H-pyrrolo[2,3-b]pyrazine-2-carboxylate
CID 134540913
2-methyl-1,4-dihydropyrrolo[2,3-d]imidazole
CID 69288445

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine (CID 168797976) is 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine is Cc1nc2[nH]ccc2nc1C(C)C.
What is the InChIKey of 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is SDIYRNKDNBVFOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-6(2)9-7(3)12-10-8(13-9)4-5-11-10/h4-6H,1-3H3,(H,11,12).
What are the key properties of 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine?
3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 175.24 g/mol, XLogP of 2.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 168797976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).