6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane

C12H22N4 — CID 91242494

IUPAC6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane
SMILESCC.CNc1nc(C)nc(N2CCC2)c1C
InChIInChI=1S/C10H16N4.C2H6/c1-7-9(11-3)12-8(2)13-10(7)14-5-4-6-14;1-2/h4-6H2,1-3H3,(H,11,12,13);1-2H3
InChIKeyIYMTVTYKLHGTFK-UHFFFAOYSA-N
MW222.34 g/mol
LogP2.37
Rot. Bonds2

About 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane

6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane (PubChem CID 91242494) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane.

Molecular Properties

Compound Name6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane
PubChem CID91242494
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane
SMILESCC.CNc1nc(C)nc(N2CCC2)c1C
InChIInChI=1S/C10H16N4.C2H6/c1-7-9(11-3)12-8(2)13-10(7)14-5-4-6-14;1-2/h4-6H2,1-3H3,(H,11,12,13);1-2H3
InChIKeyIYMTVTYKLHGTFK-UHFFFAOYSA-N
XLogP2.37
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-tert-butylpiperazin-1-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 80795535
1-[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-4-methylpiperidin-4-ol
CID 81107819
6-(4-ethylpiperidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 80795154
4-[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-1-methylpiperazin-2-one
CID 80844651
6-[3-(dimethylamino)piperidin-1-yl]-N,2,5-trimethylpyrimidin-4-amine
CID 80856401
6-(3,4-dimethoxypyrrolidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 103541950
6-(2,2-dimethylpyrrolidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 80828637
6-[4-[(dimethylamino)methyl]piperidin-1-yl]-N,2,5-trimethylpyrimidin-4-amine
CID 80805607
4-(azetidin-1-yl)-5-methyl-6-(methylamino)pyrimidine-2-carboxamide
CID 58937972
N,2,5-trimethyl-6-(3-propan-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
CID 113419461
6-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N,2,5-trimethylpyrimidin-4-amine
CID 102729117
N,2,5-trimethyl-6-(2-propan-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80856296

Frequently Asked Questions

What is the IUPAC name of 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane?
The IUPAC name of 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane (CID 91242494) is 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane.
What is the SMILES notation for 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane?
The canonical SMILES for 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane is CC.CNc1nc(C)nc(N2CCC2)c1C.
What is the InChIKey of 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane?
The InChIKey is IYMTVTYKLHGTFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4.C2H6/c1-7-9(11-3)12-8(2)13-10(7)14-5-4-6-14;1-2/h4-6H2,1-3H3,(H,11,12,13);1-2H3.
What are the key properties of 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane?
6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane has a molecular weight of 222.34 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(azetidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine;ethane is sourced from PubChem (CID 91242494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).