2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine

C10H17ClN4 — CID 142547373

IUPAC2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine
SMILESCC.CN.Cc1c[nH]c2ncc(Cl)nc12
InChIInChI=1S/C7H6ClN3.C2H6.CH5N/c1-4-2-9-7-6(4)11-5(8)3-10-7;2*1-2/h2-3H,1H3,(H,9,10);1-2H3;2H2,1H3
InChIKeyIMHYIDKJCVDPCH-UHFFFAOYSA-N
MW228.73 g/mol
LogP2.52
Rot. Bonds

About 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine

2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine (PubChem CID 142547373) has the molecular formula C10H17ClN4 and a molecular weight of 228.73 g/mol. Its IUPAC name is 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine.

Molecular Properties

Compound Name2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine
PubChem CID142547373
Molecular FormulaC10H17ClN4
Molecular Weight228.73 g/mol
Exact Mass228.11
IUPAC Name2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine
SMILESCC.CN.Cc1c[nH]c2ncc(Cl)nc12
InChIInChI=1S/C7H6ClN3.C2H6.CH5N/c1-4-2-9-7-6(4)11-5(8)3-10-7;2*1-2/h2-3H,1H3,(H,9,10);1-2H3;2H2,1H3
InChIKeyIMHYIDKJCVDPCH-UHFFFAOYSA-N
XLogP2.52
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.73
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

CID 170788920
CID 170788920
7-methyl-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazin-2-amine
CID 144894336
2-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-5-fluoropyridin-4-amine
CID 123957732
2-chloro-7-iodo-5H-pyrrolo[2,3-b]pyrazine;2-chloro-5H-pyrrolo[2,3-b]pyrazine
CID 158480244
4-chloro-3-methyl-5-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine
CID 146567972
3-chloro-5H-pyrrolo[2,3-b]pyrazine-7-carbaldehyde
CID 82654716
2-chloro-4-methoxy-7-methyl-5H-pyrrolo[3,2-d]pyrimidine;ethane
CID 155571653
5-bromo-3-methyl-1H-pyrrolo[2,3-b]pyridine;ethane
CID 145223715
2,7-diiodo-5H-pyrrolo[2,3-b]pyrazine
CID 88944324
5-chloro-3-methylpyrazin-2-amine
CID 53424289
7-methoxy-2-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 170012027
7-tert-butyl-2-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 147144510

Frequently Asked Questions

What is the IUPAC name of 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine?
The IUPAC name of 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine (CID 142547373) is 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine.
What is the SMILES notation for 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine?
The canonical SMILES for 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine is CC.CN.Cc1c[nH]c2ncc(Cl)nc12.
What is the InChIKey of 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine?
The InChIKey is IMHYIDKJCVDPCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN3.C2H6.CH5N/c1-4-2-9-7-6(4)11-5(8)3-10-7;2*1-2/h2-3H,1H3,(H,9,10);1-2H3;2H2,1H3.
What are the key properties of 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine?
2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine has a molecular weight of 228.73 g/mol, XLogP of 2.52, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-7-methyl-5H-pyrrolo[2,3-b]pyrazine;ethane;methanamine is sourced from PubChem (CID 142547373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).