2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine

C13H22N4 — CID 63767587

IUPAC2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine
SMILESCc1cc(N2CCCCC2CCN)nc(C)n1
InChIInChI=1S/C13H22N4/c1-10-9-13(16-11(2)15-10)17-8-4-3-5-12(17)6-7-14/h9,12H,3-8,14H2,1-2H3
InChIKeyQDRVYGDBXNNOAR-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.80
Rot. Bonds3

About 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine

2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine (PubChem CID 63767587) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine
PubChem CID63767587
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine
SMILESCc1cc(N2CCCCC2CCN)nc(C)n1
InChIInChI=1S/C13H22N4/c1-10-9-13(16-11(2)15-10)17-8-4-3-5-12(17)6-7-14/h9,12H,3-8,14H2,1-2H3
InChIKeyQDRVYGDBXNNOAR-UHFFFAOYSA-N
XLogP1.80
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(2-chloroethyl)piperidin-1-yl]-2,6-dimethylpyrimidine
CID 55184425
N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine
CID 55218834
4,6-bis(2-ethylpiperidin-1-yl)-2-methylpyrimidine
CID 112876455
2-[1-(6-methylpyridazin-3-yl)piperidin-2-yl]ethanamine
CID 63655181
4-methyl-6-(2-propylpiperidin-1-yl)pyrimidin-2-amine
CID 83056730
2-[6-[(2R)-2-ethylpiperidin-1-yl]-2-methylpyrimidin-4-yl]ethanamine
CID 95218180
2-[1-(4-methyl-2-pyridinyl)piperidin-2-yl]ethanamine
CID 63766267
[1-(6-amino-2-methylpyrimidin-4-yl)piperidin-2-yl]methanol
CID 80794563
2-[1-(2-methylquinolin-4-yl)piperidin-2-yl]ethanamine
CID 63767577
2-[2-(2-aminoethyl)piperidin-1-yl]-4,6-dimethylpyridine-3-carboxamide
CID 63767584
N-[[1-(2,6-dimethylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-2-methylpropan-2-amine
CID 62592513
[1-(2-amino-6-methylpyrimidin-4-yl)piperidin-2-yl]methanol
CID 112726024

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine?
The IUPAC name of 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine (CID 63767587) is 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine.
What is the SMILES notation for 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine?
The canonical SMILES for 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine is Cc1cc(N2CCCCC2CCN)nc(C)n1.
What is the InChIKey of 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine?
The InChIKey is QDRVYGDBXNNOAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-10-9-13(16-11(2)15-10)17-8-4-3-5-12(17)6-7-14/h9,12H,3-8,14H2,1-2H3.
What are the key properties of 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine?
2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine has a molecular weight of 234.35 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]ethanamine is sourced from PubChem (CID 63767587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).