4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine

C8H14N4 — CID 137384091

IUPAC4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine
SMILESCCNc1nc(N)nc(C)c1C
InChIInChI=1S/C8H14N4/c1-4-10-7-5(2)6(3)11-8(9)12-7/h4H2,1-3H3,(H3,9,10,11,12)
InChIKeyKKIXLOZILLJRME-UHFFFAOYSA-N
MW166.23 g/mol
LogP1.11
Rot. Bonds2

About 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine

4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine (PubChem CID 137384091) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine
PubChem CID137384091
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine
SMILESCCNc1nc(N)nc(C)c1C
InChIInChI=1S/C8H14N4/c1-4-10-7-5(2)6(3)11-8(9)12-7/h4H2,1-3H3,(H3,9,10,11,12)
InChIKeyKKIXLOZILLJRME-UHFFFAOYSA-N
XLogP1.11
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-butyl-5,6-dimethylpyrimidine-2,4-diamine
CID 135271001
N-ethyl-5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-amine
CID 62192547
methyl 3-[2-amino-4-(ethylamino)-6-methylpyrimidin-5-yl]prop-2-enoate
CID 123886095
5,6-dimethyl-4-N-[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]pyrimidine-2,4-diamine
CID 72918603
4-N-ethylpyrimidine-2,4,5-triamine
CID 167243214
N-ethyl-5,6-dimethyl-2-(5-methylthiophen-2-yl)pyrimidin-4-amine
CID 62202443
2-[(2-bromophenyl)methyl]-N-ethyl-5,6-dimethylpyrimidin-4-amine
CID 62830547
4-[4-(ethylamino)-5,6-dimethylpyrimidin-2-yl]-2,6-dimethylphenol
CID 135978666
2-(2,5-dimethylthiophen-3-yl)-N-ethyl-5,6-dimethylpyrimidin-4-amine
CID 55045831
4-N-ethyl-6-methyl-5-[3-methyl-3-[4-(trifluoromethyl)phenyl]butyl]pyrimidine-2,4-diamine
CID 134105930
2-amino-4-(butylamino)-6-methylpyrimidine-5-thiol
CID 134572760
4-N,5-dibutyl-6-methylpyrimidine-2,4-diamine
CID 135271003

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine?
The IUPAC name of 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine (CID 137384091) is 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine?
The canonical SMILES for 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine is CCNc1nc(N)nc(C)c1C.
What is the InChIKey of 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine?
The InChIKey is KKIXLOZILLJRME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-4-10-7-5(2)6(3)11-8(9)12-7/h4H2,1-3H3,(H3,9,10,11,12).
What are the key properties of 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine?
4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine has a molecular weight of 166.23 g/mol, XLogP of 1.11, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-5,6-dimethylpyrimidine-2,4-diamine is sourced from PubChem (CID 137384091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).