N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine

C11H18N4 — CID 114477674

IUPACN-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine
SMILESCc1ncc(NCC2(CN)CC2)nc1C
InChIInChI=1S/C11H18N4/c1-8-9(2)15-10(5-13-8)14-7-11(6-12)3-4-11/h5H,3-4,6-7,12H2,1-2H3,(H,14,15)
InChIKeyAZALHJAYAYYUST-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.24
Rot. Bonds4

About N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine

N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine (PubChem CID 114477674) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine
PubChem CID114477674
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC NameN-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine
SMILESCc1ncc(NCC2(CN)CC2)nc1C
InChIInChI=1S/C11H18N4/c1-8-9(2)15-10(5-13-8)14-7-11(6-12)3-4-11/h5H,3-4,6-7,12H2,1-2H3,(H,14,15)
InChIKeyAZALHJAYAYYUST-UHFFFAOYSA-N
XLogP1.24
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine (CID 114477674) is N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine is Cc1ncc(NCC2(CN)CC2)nc1C.
What is the InChIKey of N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine?
The InChIKey is AZALHJAYAYYUST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-8-9(2)15-10(5-13-8)14-7-11(6-12)3-4-11/h5H,3-4,6-7,12H2,1-2H3,(H,14,15).
What are the key properties of N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine?
N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine has a molecular weight of 206.29 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclopropyl]methyl]-5,6-dimethylpyrazin-2-amine is sourced from PubChem (CID 114477674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).