2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine

C11H20N4 — CID 80933934

IUPAC2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine
SMILESCCCC(C)Nc1cc(N)nc(CC)n1
InChIInChI=1S/C11H20N4/c1-4-6-8(3)13-11-7-9(12)14-10(5-2)15-11/h7-8H,4-6H2,1-3H3,(H3,12,13,14,15)
InChIKeyNSKRGNRQNVBGOY-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.22
Rot. Bonds5

About 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine

2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine (PubChem CID 80933934) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine
PubChem CID80933934
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine
SMILESCCCC(C)Nc1cc(N)nc(CC)n1
InChIInChI=1S/C11H20N4/c1-4-6-8(3)13-11-7-9(12)14-10(5-2)15-11/h7-8H,4-6H2,1-3H3,(H3,12,13,14,15)
InChIKeyNSKRGNRQNVBGOY-UHFFFAOYSA-N
XLogP2.22
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-6-hydrazinyl-N-pentan-2-ylpyrimidin-4-amine
CID 80940178
4-N-hexan-2-yl-2-propylpyrimidine-4,6-diamine
CID 80954835
2-ethyl-4-N-octan-4-ylpyrimidine-4,6-diamine
CID 106028697
methyl 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]propanoate
CID 80935382
4-N-pentan-2-ylpyrimidine-4,6-diamine
CID 78929734
2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide
CID 80935004
2-N-pentan-2-ylpyrazine-2,6-diamine
CID 78988938
2-methyl-4-N-(5-methylhexan-2-yl)pyrimidine-4,6-diamine
CID 80838338
4-N-octan-4-yl-2-propylpyrimidine-4,6-diamine
CID 106028699
2-ethyl-4-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 113387604
2-(methoxymethyl)-4-N-(1-methoxypentan-2-yl)pyrimidine-4,6-diamine
CID 113401520
2-ethyl-4-N-octylpyrimidine-4,6-diamine
CID 113336788

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine?
The IUPAC name of 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine (CID 80933934) is 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine.
What is the SMILES notation for 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine?
The canonical SMILES for 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine is CCCC(C)Nc1cc(N)nc(CC)n1.
What is the InChIKey of 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine?
The InChIKey is NSKRGNRQNVBGOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-4-6-8(3)13-11-7-9(12)14-10(5-2)15-11/h7-8H,4-6H2,1-3H3,(H3,12,13,14,15).
What are the key properties of 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine?
2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine has a molecular weight of 208.31 g/mol, XLogP of 2.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine is sourced from PubChem (CID 80933934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).