N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine

C13H22N4 — CID 66457957

IUPACN-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine
SMILESCNCc1cncc(N(C)C2CCCCC2)n1
InChIInChI=1S/C13H22N4/c1-14-8-11-9-15-10-13(16-11)17(2)12-6-4-3-5-7-12/h9-10,12,14H,3-8H2,1-2H3
InChIKeyPPBSKFPQCTTWFP-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.96
Rot. Bonds4

About N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine

N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine (PubChem CID 66457957) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine
PubChem CID66457957
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC NameN-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine
SMILESCNCc1cncc(N(C)C2CCCCC2)n1
InChIInChI=1S/C13H22N4/c1-14-8-11-9-15-10-13(16-11)17(2)12-6-4-3-5-7-12/h9-10,12,14H,3-8H2,1-2H3
InChIKeyPPBSKFPQCTTWFP-UHFFFAOYSA-N
XLogP1.96
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine?
The IUPAC name of N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine (CID 66457957) is N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine.
What is the SMILES notation for N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine?
The canonical SMILES for N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine is CNCc1cncc(N(C)C2CCCCC2)n1.
What is the InChIKey of N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine?
The InChIKey is PPBSKFPQCTTWFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-14-8-11-9-15-10-13(16-11)17(2)12-6-4-3-5-7-12/h9-10,12,14H,3-8H2,1-2H3.
What are the key properties of N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine?
N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine has a molecular weight of 234.35 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-6-(methylaminomethyl)pyrazin-2-amine is sourced from PubChem (CID 66457957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).