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

C13H22N4 — CID 107415935

IUPAC6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine
SMILESCCNc1cncc(NCC2CCC(C)C2)n1
InChIInChI=1S/C13H22N4/c1-3-15-12-8-14-9-13(17-12)16-7-11-5-4-10(2)6-11/h8-11H,3-7H2,1-2H3,(H2,15,16,17)
InChIKeyUTONDTGJUMYNLZ-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.76
Rot. Bonds5

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

6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine (PubChem CID 107415935) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine
PubChem CID107415935
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine
SMILESCCNc1cncc(NCC2CCC(C)C2)n1
InChIInChI=1S/C13H22N4/c1-3-15-12-8-14-9-13(17-12)16-7-11-5-4-10(2)6-11/h8-11H,3-7H2,1-2H3,(H2,15,16,17)
InChIKeyUTONDTGJUMYNLZ-UHFFFAOYSA-N
XLogP2.76
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-6-N-ethyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-4,6-diamine
CID 107415826
6-hydrazinyl-N-[(4-methylcyclohexyl)methyl]pyrazin-2-amine
CID 80914019
5,6-dimethyl-N-[(3-methylcyclopentyl)methyl]pyrazin-2-amine
CID 107414033
6-N-ethyl-2-N-(3-methylcyclohexyl)pyrazine-2,6-diamine
CID 78918211
4-N-[(3-methylcyclopentyl)methyl]-2-propylpyrimidine-4,6-diamine
CID 107415976
N-(cyclopropylmethyl)-6-hydrazinylpyrazin-2-amine
CID 80932571
4-methyl-N-[(3-methylcyclopentyl)methyl]pyridin-2-amine
CID 107413738
6-bromo-2-ethyl-N-[(3-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107414820
6-N-ethyl-2-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrazine-2,6-diamine
CID 80848530
N-ethyl-6-(4-methylcyclohexyl)oxypyrazin-2-amine
CID 80858436
6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine
CID 107416016
methyl 6-[(4-methylcyclohexyl)methylamino]pyrazine-2-carboxylate
CID 66455933

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine?
The IUPAC name of 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine (CID 107415935) is 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine is CCNc1cncc(NCC2CCC(C)C2)n1.
What is the InChIKey of 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine?
The InChIKey is UTONDTGJUMYNLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-3-15-12-8-14-9-13(17-12)16-7-11-5-4-10(2)6-11/h8-11H,3-7H2,1-2H3,(H2,15,16,17).
What are the key properties of 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine?
6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine has a molecular weight of 234.35 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-[(3-methylcyclopentyl)methyl]pyrazine-2,6-diamine is sourced from PubChem (CID 107415935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).