4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine

C13H24N4 — CID 80774156

IUPAC4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
SMILESCCN(CC(C)C)c1nc(C)nc(NC)c1C
InChIInChI=1S/C13H24N4/c1-7-17(8-9(2)3)13-10(4)12(14-6)15-11(5)16-13/h9H,7-8H2,1-6H3,(H,14,15,16)
InChIKeyDHGWZVCWUXAEFB-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.62
Rot. Bonds5

About 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine

4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine (PubChem CID 80774156) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
PubChem CID80774156
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
SMILESCCN(CC(C)C)c1nc(C)nc(NC)c1C
InChIInChI=1S/C13H24N4/c1-7-17(8-9(2)3)13-10(4)12(14-6)15-11(5)16-13/h9H,7-8H2,1-6H3,(H,14,15,16)
InChIKeyDHGWZVCWUXAEFB-UHFFFAOYSA-N
XLogP2.62
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N,6-N-diethyl-2,5-dimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
CID 80774157
3-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-(2-methylpropyl)amino]propanenitrile
CID 80812373
2-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-(2-methylpropyl)amino]acetamide
CID 80820561
2-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-ethylamino]-N-propan-2-ylacetamide
CID 80805162
4-N-ethyl-4-N-(2-methoxyethyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine
CID 80808572
1-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-ethylamino]-2-methylpropan-2-ol
CID 80848781
4-N-[2-(dimethylamino)ethyl]-6-N-ethyl-2,5-dimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
CID 80788923
4-N,6-N-diethyl-5-methyl-4-N-(2-methylpropyl)-2-propylpyrimidine-4,6-diamine
CID 80993891
N-ethyl-6-hydrazinyl-5-methyl-N-(2-methylpropyl)-2-propylpyrimidin-4-amine
CID 80995591
2-ethyl-4-N-(2-methoxyethyl)-6-N,5-dimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
CID 80987716
4-N-ethyl-6-N,2,5-trimethyl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine
CID 80798913
4-N-(1-methoxypropan-2-yl)-4-N,6-N,2,5-tetramethylpyrimidine-4,6-diamine
CID 80809386

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine?
The IUPAC name of 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine (CID 80774156) is 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine?
The canonical SMILES for 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine is CCN(CC(C)C)c1nc(C)nc(NC)c1C.
What is the InChIKey of 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine?
The InChIKey is DHGWZVCWUXAEFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-7-17(8-9(2)3)13-10(4)12(14-6)15-11(5)16-13/h9H,7-8H2,1-6H3,(H,14,15,16).
What are the key properties of 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine?
4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine has a molecular weight of 236.36 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-6-N,2,5-trimethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 80774156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).