5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine

C11H20N4 — CID 94587541

IUPAC5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine
SMILESCCN(CC)c1ncc([C@@H](C)N)c(C)n1
InChIInChI=1S/C11H20N4/c1-5-15(6-2)11-13-7-10(8(3)12)9(4)14-11/h7-8H,5-6,12H2,1-4H3/t8-/m1/s1
InChIKeyYYOAVQMNCZZQQT-MRVPVSSYSA-N
MW208.31 g/mol
LogP1.65
Rot. Bonds4

About 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine

5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine (PubChem CID 94587541) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine.

Molecular Properties

Compound Name5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine
PubChem CID94587541
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine
SMILESCCN(CC)c1ncc([C@@H](C)N)c(C)n1
InChIInChI=1S/C11H20N4/c1-5-15(6-2)11-13-7-10(8(3)12)9(4)14-11/h7-8H,5-6,12H2,1-4H3/t8-/m1/s1
InChIKeyYYOAVQMNCZZQQT-MRVPVSSYSA-N
XLogP1.65
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(diethylamino)-4-methylpyrimidin-5-yl]methanol
CID 83183758
1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine
CID 62770485
(1R)-1-[4-methyl-2-(5-methylpyrimidin-2-yl)pyrimidin-5-yl]ethanamine
CID 103431871
N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine
CID 83186097
[2-[ethyl(2-methylbutyl)amino]-4-methylpyrimidin-5-yl]methanol
CID 83184985
1-[2-(1-methoxypropyl)-4-methylpyrimidin-5-yl]ethanamine
CID 116731307
N,N,4-trimethyl-5-[1-(propylamino)ethyl]pyrimidin-2-amine
CID 62770147
(1R)-1-[4-methyl-2-(methylsulfanylmethyl)pyrimidin-5-yl]ethanamine
CID 94587549
1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanamine
CID 116731311
N,N,4-trimethyl-5-propan-2-ylpyrimidin-2-amine
CID 130210355
5-chloro-2-N,2-N-diethylpyrimidine-2,4-diamine
CID 84669787
1-[2-(2-methoxybutan-2-yl)-4-methylpyrimidin-5-yl]ethanamine
CID 116778873

Frequently Asked Questions

What is the IUPAC name of 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine?
The IUPAC name of 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine (CID 94587541) is 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine.
What is the SMILES notation for 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine?
The canonical SMILES for 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine is CCN(CC)c1ncc([C@@H](C)N)c(C)n1.
What is the InChIKey of 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine?
The InChIKey is YYOAVQMNCZZQQT-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H20N4/c1-5-15(6-2)11-13-7-10(8(3)12)9(4)14-11/h7-8H,5-6,12H2,1-4H3/t8-/m1/s1.
What are the key properties of 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine?
5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine has a molecular weight of 208.31 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1R)-1-aminoethyl]-N,N-diethyl-4-methylpyrimidin-2-amine is sourced from PubChem (CID 94587541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).