N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine

C16H26N4 — CID 107380276

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine
SMILESCCNCc1cnc(N(C)CC2CC3CCC2C3)cn1
InChIInChI=1S/C16H26N4/c1-3-17-8-15-9-19-16(10-18-15)20(2)11-14-7-12-4-5-13(14)6-12/h9-10,12-14,17H,3-8,11H2,1-2H3
InChIKeyXIBSHXILCLCSJJ-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.46
Rot. Bonds6

About N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine

N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine (PubChem CID 107380276) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine
PubChem CID107380276
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine
SMILESCCNCc1cnc(N(C)CC2CC3CCC2C3)cn1
InChIInChI=1S/C16H26N4/c1-3-17-8-15-9-19-16(10-18-15)20(2)11-14-7-12-4-5-13(14)6-12/h9-10,12-14,17H,3-8,11H2,1-2H3
InChIKeyXIBSHXILCLCSJJ-UHFFFAOYSA-N
XLogP2.46
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]pyrazin-2-yl]methanol
CID 107372861
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N,2-dimethylpyridin-4-amine
CID 81253943
N-(2-bicyclo[2.2.1]heptanylmethyl)-3-chloro-5-(ethylaminomethyl)-N-methylpyridin-2-amine
CID 63683088
N-ethyl-5-(ethylaminomethyl)-N-methylpyrazin-2-amine
CID 107379070
N-(2-bicyclo[2.2.1]heptanylmethyl)-4-(ethylaminomethyl)-3-fluoro-N-methylpyridin-2-amine
CID 105389902
6-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]pyridine-3-carboxylic acid
CID 63682341
5-(ethylaminomethyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpyrazin-2-amine
CID 107380506
4-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine
CID 80833914
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-2-(ethylaminomethyl)-N-methylaniline
CID 63682139
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-iodo-N-methylpyrimidin-2-amine
CID 116648985
6-N-(2-bicyclo[2.2.1]heptanylmethyl)-6-N-methylpyridine-2,6-diamine
CID 80652293
N-(2-bicyclo[2.2.1]heptanylmethyl)-6-chloro-N-methylpyrimidin-4-amine
CID 63686843

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine (CID 107380276) is N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine is CCNCc1cnc(N(C)CC2CC3CCC2C3)cn1.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine?
The InChIKey is XIBSHXILCLCSJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-3-17-8-15-9-19-16(10-18-15)20(2)11-14-7-12-4-5-13(14)6-12/h9-10,12-14,17H,3-8,11H2,1-2H3.
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine?
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine has a molecular weight of 274.41 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-(ethylaminomethyl)-N-methylpyrazin-2-amine is sourced from PubChem (CID 107380276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).