5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine

C8H14N4 — CID 126972399

IUPAC5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine
SMILESCCNc1nc(C)ncc1CN
InChIInChI=1S/C8H14N4/c1-3-10-8-7(4-9)5-11-6(2)12-8/h5H,3-4,9H2,1-2H3,(H,10,11,12)
InChIKeyJZWDEIITWPYQLM-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.68
Rot. Bonds3

About 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine

5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine (PubChem CID 126972399) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine
PubChem CID126972399
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine
SMILESCCNc1nc(C)ncc1CN
InChIInChI=1S/C8H14N4/c1-3-10-8-7(4-9)5-11-6(2)12-8/h5H,3-4,9H2,1-2H3,(H,10,11,12)
InChIKeyJZWDEIITWPYQLM-UHFFFAOYSA-N
XLogP0.68
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2,4-dimethylpyrimidin-5-amine
CID 171795790
N-methyl-2-[(2-methyl-5-propylpyrimidin-4-yl)amino]ethanesulfonamide
CID 50970084
5-ethyl-2-methylpyrimidin-4-amine
CID 22978191
N-[(4-ethyl-2-methyl-1,3-thiazol-5-yl)methyl]-2-methyl-5-propylpyrimidin-4-amine
CID 135116875
N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methyl-5-propylpyrimidin-4-amine
CID 134709086
[1-[[(2-methyl-5-propylpyrimidin-4-yl)amino]methyl]cyclobutyl]methanol
CID 131905026
5-(aminomethyl)-4-methyl-N-propylpyridin-2-amine
CID 102545289
3-[[(5-ethyl-2-methylpyrimidin-4-yl)amino]methyl]benzonitrile
CID 134702880
N-tert-butyl-2-methyl-5-(propylaminomethyl)pyrimidin-4-amine
CID 114216522
N-ethyl-N'-(5-ethyl-2-methylpyrimidin-4-yl)-N,2-dimethylpropane-1,3-diamine
CID 135105473
N-[[4-(aminomethyl)phenyl]methyl]-2-methyl-5-propan-2-ylpyrimidin-4-amine
CID 122561201
2-methyl-N-(oxan-3-ylmethyl)-5-propylpyrimidin-4-amine
CID 134698138

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine?
The IUPAC name of 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine (CID 126972399) is 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine.
What is the SMILES notation for 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine?
The canonical SMILES for 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine is CCNc1nc(C)ncc1CN.
What is the InChIKey of 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine?
The InChIKey is JZWDEIITWPYQLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-3-10-8-7(4-9)5-11-6(2)12-8/h5H,3-4,9H2,1-2H3,(H,10,11,12).
What are the key properties of 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine?
5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine has a molecular weight of 166.23 g/mol, XLogP of 0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-ethyl-2-methylpyrimidin-4-amine is sourced from PubChem (CID 126972399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).