4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine

C8H16N4 — CID 135136164

IUPAC4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine
SMILESCNC(C)C1=CC(C)(N)N=CN1
InChIInChI=1S/C8H16N4/c1-6(10-3)7-4-8(2,9)12-5-11-7/h4-6,10H,9H2,1-3H3,(H,11,12)
InChIKeyTYQYXXUVJDZUIF-UHFFFAOYSA-N
MW168.24 g/mol
LogP-0.22
Rot. Bonds2

About 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine

4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine (PubChem CID 135136164) has the molecular formula C8H16N4 and a molecular weight of 168.24 g/mol. Its IUPAC name is 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine.

Molecular Properties

Compound Name4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine
PubChem CID135136164
Molecular FormulaC8H16N4
Molecular Weight168.24 g/mol
Exact Mass168.14
IUPAC Name4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine
SMILESCNC(C)C1=CC(C)(N)N=CN1
InChIInChI=1S/C8H16N4/c1-6(10-3)7-4-8(2,9)12-5-11-7/h4-6,10H,9H2,1-3H3,(H,11,12)
InChIKeyTYQYXXUVJDZUIF-UHFFFAOYSA-N
XLogP-0.22
TPSA62.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine?
The IUPAC name of 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine (CID 135136164) is 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine.
What is the SMILES notation for 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine?
The canonical SMILES for 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine is CNC(C)C1=CC(C)(N)N=CN1.
What is the InChIKey of 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine?
The InChIKey is TYQYXXUVJDZUIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4/c1-6(10-3)7-4-8(2,9)12-5-11-7/h4-6,10H,9H2,1-3H3,(H,11,12).
What are the key properties of 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine?
4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine has a molecular weight of 168.24 g/mol, XLogP of -0.22, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[1-(methylamino)ethyl]-1H-pyrimidin-4-amine is sourced from PubChem (CID 135136164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).