6-methyl-N-pentan-3-ylpyrazin-2-amine

C10H17N3 — CID 45099732

IUPAC6-methyl-N-pentan-3-ylpyrazin-2-amine
SMILESCCC(CC)Nc1cncc(C)n1
InChIInChI=1S/C10H17N3/c1-4-9(5-2)13-10-7-11-6-8(3)12-10/h6-7,9H,4-5H2,1-3H3,(H,12,13)
InChIKeyNNZUJYJBCPCXNC-UHFFFAOYSA-N
MW179.27 g/mol
LogP2.39
Rot. Bonds4

About 6-methyl-N-pentan-3-ylpyrazin-2-amine

6-methyl-N-pentan-3-ylpyrazin-2-amine (PubChem CID 45099732) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 6-methyl-N-pentan-3-ylpyrazin-2-amine.

Molecular Properties

Compound Name6-methyl-N-pentan-3-ylpyrazin-2-amine
PubChem CID45099732
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name6-methyl-N-pentan-3-ylpyrazin-2-amine
SMILESCCC(CC)Nc1cncc(C)n1
InChIInChI=1S/C10H17N3/c1-4-9(5-2)13-10-7-11-6-8(3)12-10/h6-7,9H,4-5H2,1-3H3,(H,12,13)
InChIKeyNNZUJYJBCPCXNC-UHFFFAOYSA-N
XLogP2.39
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-pentan-3-ylpyrazin-2-amine?
The IUPAC name of 6-methyl-N-pentan-3-ylpyrazin-2-amine (CID 45099732) is 6-methyl-N-pentan-3-ylpyrazin-2-amine.
What is the SMILES notation for 6-methyl-N-pentan-3-ylpyrazin-2-amine?
The canonical SMILES for 6-methyl-N-pentan-3-ylpyrazin-2-amine is CCC(CC)Nc1cncc(C)n1.
What is the InChIKey of 6-methyl-N-pentan-3-ylpyrazin-2-amine?
The InChIKey is NNZUJYJBCPCXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-4-9(5-2)13-10-7-11-6-8(3)12-10/h6-7,9H,4-5H2,1-3H3,(H,12,13).
What are the key properties of 6-methyl-N-pentan-3-ylpyrazin-2-amine?
6-methyl-N-pentan-3-ylpyrazin-2-amine has a molecular weight of 179.27 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-pentan-3-ylpyrazin-2-amine is sourced from PubChem (CID 45099732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).