6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine

C13H17N5 — CID 78990492

IUPAC6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine
SMILESCCNc1cncc(NCc2ccc(C)nc2)n1
InChIInChI=1S/C13H17N5/c1-3-15-12-8-14-9-13(18-12)17-7-11-5-4-10(2)16-6-11/h4-6,8-9H,3,7H2,1-2H3,(H2,15,17,18)
InChIKeyNNGLWONBYGXSMI-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.22
Rot. Bonds5

About 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine

6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine (PubChem CID 78990492) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine
PubChem CID78990492
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC Name6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine
SMILESCCNc1cncc(NCc2ccc(C)nc2)n1
InChIInChI=1S/C13H17N5/c1-3-15-12-8-14-9-13(18-12)17-7-11-5-4-10(2)16-6-11/h4-6,8-9H,3,7H2,1-2H3,(H2,15,17,18)
InChIKeyNNGLWONBYGXSMI-UHFFFAOYSA-N
XLogP2.22
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-4-N-[(6-methyl-3-pyridinyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80831369
2-ethyl-6-N-methyl-4-N-[(6-methyl-3-pyridinyl)methyl]pyrimidine-4,6-diamine
CID 80934553
4-N-[(6-methyl-3-pyridinyl)methyl]pyrimidine-2,4-diamine
CID 80831876
5-fluoro-N-[(6-methyl-3-pyridinyl)methyl]pyridin-2-amine
CID 62995202
2,3,4,5,6-pentafluoro-N-[(6-methyl-3-pyridinyl)methyl]aniline
CID 60965717
6-N-ethyl-2-N-(4-propylphenyl)pyrazine-2,6-diamine
CID 80778845
2-(ethylamino)-N-[(6-methyl-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 62990051
6-N,5-dimethyl-4-N-[(6-methyl-3-pyridinyl)methyl]-2-propylpyrimidine-4,6-diamine
CID 80985315
2-cyclopropyl-6-hydrazinyl-N-[(6-methyl-3-pyridinyl)methyl]pyrimidin-4-amine
CID 80964280
N-[(4-ethoxy-3-methylphenyl)methyl]-6-methylpyrazin-2-amine
CID 133470930
6-N-ethyl-2-N-(4-methylphenyl)pyrazine-2,6-diamine
CID 80761835
3-methyl-N-[(6-methyl-3-pyridinyl)methyl]pyrazin-2-amine
CID 83064247

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine?
The IUPAC name of 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine (CID 78990492) is 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine is CCNc1cncc(NCc2ccc(C)nc2)n1.
What is the InChIKey of 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine?
The InChIKey is NNGLWONBYGXSMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5/c1-3-15-12-8-14-9-13(18-12)17-7-11-5-4-10(2)16-6-11/h4-6,8-9H,3,7H2,1-2H3,(H2,15,17,18).
What are the key properties of 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine?
6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine has a molecular weight of 243.31 g/mol, XLogP of 2.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-[(6-methyl-3-pyridinyl)methyl]pyrazine-2,6-diamine is sourced from PubChem (CID 78990492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).