N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine

C14H18N4 — CID 83063231

IUPACN-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine
SMILESCc1nccnc1N(C)Cc1ccccc1CN
InChIInChI=1S/C14H18N4/c1-11-14(17-8-7-16-11)18(2)10-13-6-4-3-5-12(13)9-15/h3-8H,9-10,15H2,1-2H3
InChIKeyFTTKQUIHSNLYDP-UHFFFAOYSA-N
MW242.33 g/mol
LogP1.88
Rot. Bonds4

About N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine

N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine (PubChem CID 83063231) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine.

Molecular Properties

Compound NameN-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine
PubChem CID83063231
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC NameN-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine
SMILESCc1nccnc1N(C)Cc1ccccc1CN
InChIInChI=1S/C14H18N4/c1-11-14(17-8-7-16-11)18(2)10-13-6-4-3-5-12(13)9-15/h3-8H,9-10,15H2,1-2H3
InChIKeyFTTKQUIHSNLYDP-UHFFFAOYSA-N
XLogP1.88
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(aminomethyl)phenyl]methyl]-3-bromo-N,4-dimethylpyridin-2-amine
CID 106875252
N-benzyl-N,3-dimethylpyrazin-2-amine;ethane
CID 145242073
N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridin-2-amine
CID 60921940
[2-[(dimethylamino)methyl]phenyl]methanamine
CID 4962718
N-[[2-(aminomethyl)phenyl]methyl]-N,6-dimethylpyridazin-3-amine
CID 61313703
4-(aminomethyl)-N-methyl-N-[(2-methylphenyl)methyl]pyridazin-3-amine
CID 80507438
N-[[2-(aminomethyl)phenyl]methyl]-N-methylphthalazin-1-amine
CID 60922847
N-[(2-aminophenyl)methyl]-N-ethyl-3-methylpyrazin-2-amine
CID 83064268
N',2,2-trimethyl-N'-(3-methylpyrazin-2-yl)propane-1,3-diamine
CID 83063799
3-(aminomethyl)-N-methyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine
CID 62672521
4-[[2-(aminomethyl)phenyl]methyl-methylamino]-5-methoxy-1H-pyrimidin-6-one
CID 136972734
N-[[2-(aminomethyl)phenyl]methyl]-3-bromo-N-ethyl-4-methylpyridin-2-amine
CID 106875251

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine?
The IUPAC name of N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine (CID 83063231) is N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine.
What is the SMILES notation for N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine?
The canonical SMILES for N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine is Cc1nccnc1N(C)Cc1ccccc1CN.
What is the InChIKey of N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine?
The InChIKey is FTTKQUIHSNLYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-11-14(17-8-7-16-11)18(2)10-13-6-4-3-5-12(13)9-15/h3-8H,9-10,15H2,1-2H3.
What are the key properties of N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine?
N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine has a molecular weight of 242.33 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylpyrazin-2-amine is sourced from PubChem (CID 83063231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).