N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine

C15H18N4 — CID 107378785

IUPACN-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine
SMILESCCNCc1cnc(N2Cc3ccccc3C2)cn1
InChIInChI=1S/C15H18N4/c1-2-16-7-14-8-18-15(9-17-14)19-10-12-5-3-4-6-13(12)11-19/h3-6,8-9,16H,2,7,10-11H2,1H3
InChIKeyKYWMNMKZQBSVDF-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.11
Rot. Bonds4

About N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine

N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine (PubChem CID 107378785) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine
PubChem CID107378785
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC NameN-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine
SMILESCCNCc1cnc(N2Cc3ccccc3C2)cn1
InChIInChI=1S/C15H18N4/c1-2-16-7-14-8-18-15(9-17-14)19-10-12-5-3-4-6-13(12)11-19/h3-6,8-9,16H,2,7,10-11H2,1H3
InChIKeyKYWMNMKZQBSVDF-UHFFFAOYSA-N
XLogP2.11
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[5-(3,4-dimethylpyrrolidin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 107380493
N-[[5-(1,1-dioxo-1,4-thiazinan-4-yl)pyrazin-2-yl]methyl]ethanamine
CID 107379251
N-[(5-pyrazol-1-ylpyrazin-2-yl)methyl]ethanamine
CID 107381116
N-[[5-(3-propan-2-ylpyrrolidin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 107380838
1-[5-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)pyrazin-2-yl]-N-methylmethanamine
CID 107380160
N-[[5-chloro-2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-pyridinyl]methyl]ethanamine
CID 114925111
methyl 5-(1,3-dihydroisoindol-2-yl)pyrazine-2-carboxylate
CID 114059785
2-[5-(chloromethyl)pyrazin-2-yl]-3,4-dihydro-1H-isoquinoline
CID 107373295
N-[[6-(1,3-dihydroisoindol-2-yl)-5-methyl-3-pyridinyl]methyl]ethanamine
CID 80635931
N-[(5-pyrrolidin-1-ylpyrazin-2-yl)methyl]propan-1-amine
CID 107378814
N-[[5-(2-ethylpiperidin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 107379083
N-[(5-imidazol-1-ylpyrazin-2-yl)methyl]ethanamine
CID 107381127

Frequently Asked Questions

What is the IUPAC name of N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine?
The IUPAC name of N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine (CID 107378785) is N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine is CCNCc1cnc(N2Cc3ccccc3C2)cn1.
What is the InChIKey of N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine?
The InChIKey is KYWMNMKZQBSVDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-2-16-7-14-8-18-15(9-17-14)19-10-12-5-3-4-6-13(12)11-19/h3-6,8-9,16H,2,7,10-11H2,1H3.
What are the key properties of N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine?
N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine has a molecular weight of 254.34 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(1,3-dihydroisoindol-2-yl)pyrazin-2-yl]methyl]ethanamine is sourced from PubChem (CID 107378785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).