6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine

C9H10BrN5 — CID 155403307

IUPAC6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
SMILESCn1cc(CNc2cncc(Br)n2)cn1
InChIInChI=1S/C9H10BrN5/c1-15-6-7(3-13-15)2-12-9-5-11-4-8(10)14-9/h3-6H,2H2,1H3,(H,12,14)
InChIKeyZLPYJNQSSQYMCT-UHFFFAOYSA-N
MW268.12 g/mol
LogP1.58
Rot. Bonds3

About 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine

6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine (PubChem CID 155403307) has the molecular formula C9H10BrN5 and a molecular weight of 268.12 g/mol. Its IUPAC name is 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
PubChem CID155403307
Molecular FormulaC9H10BrN5
Molecular Weight268.12 g/mol
Exact Mass267.01
IUPAC Name6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
SMILESCn1cc(CNc2cncc(Br)n2)cn1
InChIInChI=1S/C9H10BrN5/c1-15-6-7(3-13-15)2-12-9-5-11-4-8(10)14-9/h3-6H,2H2,1H3,(H,12,14)
InChIKeyZLPYJNQSSQYMCT-UHFFFAOYSA-N
XLogP1.58
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.12
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 6-[(1-methylpyrazol-4-yl)methylamino]pyrazine-2-carboxylate
CID 66457699
6-N-[(1-methylpyrazol-4-yl)methyl]pyridine-2,3,6-triamine
CID 79826024
5-bromo-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyridin-2-amine
CID 115773970
6-N-methyl-4-N-[(1-methylpyrazol-4-yl)methyl]-2-propan-2-ylpyrimidine-4,6-diamine
CID 80957808
6-bromo-N-[(2-methyl-6-pyrrolidin-1-yl-4-pyridinyl)methyl]pyrazin-2-amine
CID 155951800
1,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazol-3-amine
CID 19626325
6-N-[(1-methylpyrazol-4-yl)methyl]-2-N-propylpyridine-2,6-diamine
CID 80816894
5-bromo-6-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-propan-2-ylpyrimidin-4-amine
CID 146145487
6-N-methyl-4-N-[(1-methylpyrazol-4-yl)methyl]pyrimidine-4,6-diamine
CID 80817082
2,6-dibromo-4-chloro-N-[(1-methylpyrazol-4-yl)methyl]aniline
CID 114208957
6-bromo-N-[(1-methylpyrazol-4-yl)methyl]imidazo[1,2-a]pyrazin-8-amine
CID 79947519
2-ethyl-6-hydrazinyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine
CID 80937217

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine?
The IUPAC name of 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine (CID 155403307) is 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine?
The canonical SMILES for 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine is Cn1cc(CNc2cncc(Br)n2)cn1.
What is the InChIKey of 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine?
The InChIKey is ZLPYJNQSSQYMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN5/c1-15-6-7(3-13-15)2-12-9-5-11-4-8(10)14-9/h3-6H,2H2,1H3,(H,12,14).
What are the key properties of 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine?
6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine has a molecular weight of 268.12 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 155403307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).