6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine

C14H24N4 — CID 80835406

IUPAC6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
SMILESCCNc1ncnc(N2CCCC(C)(C)C2)c1C
InChIInChI=1S/C14H24N4/c1-5-15-12-11(2)13(17-10-16-12)18-8-6-7-14(3,4)9-18/h10H,5-9H2,1-4H3,(H,15,16,17)
InChIKeyFZEFUZWFDOZUDA-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.84
Rot. Bonds3

About 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine

6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine (PubChem CID 80835406) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
PubChem CID80835406
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
SMILESCCNc1ncnc(N2CCCC(C)(C)C2)c1C
InChIInChI=1S/C14H24N4/c1-5-15-12-11(2)13(17-10-16-12)18-8-6-7-14(3,4)9-18/h10H,5-9H2,1-4H3,(H,15,16,17)
InChIKeyFZEFUZWFDOZUDA-UHFFFAOYSA-N
XLogP2.84
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3,3-dimethylpiperidin-1-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 80835703
6-(3,3-diethylpyrrolidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80855240
6-(2,2-dimethylpyrrolidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80828149
6-(8-azaspiro[4.5]decan-8-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80831776
N-ethyl-5-methyl-6-(1,4-oxazepan-4-yl)pyrimidin-4-amine
CID 80823280
6-(3,3-dimethylpyrrolidin-1-yl)-N,5-dipropylpyrimidin-4-amine
CID 80855379
N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 80793772
N,3-dimethyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]pyrrolidine-3-carboxamide
CID 106322286
N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine
CID 80788166
6-(3,3-dimethylpyrrolidin-1-yl)-5-propan-2-yl-N-propylpyrimidin-4-amine
CID 80855091
6-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80854935
N-ethyl-5-methyl-6-(2-methylpiperidin-1-yl)pyrimidin-4-amine
CID 80767326

Frequently Asked Questions

What is the IUPAC name of 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine?
The IUPAC name of 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine (CID 80835406) is 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine?
The canonical SMILES for 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine is CCNc1ncnc(N2CCCC(C)(C)C2)c1C.
What is the InChIKey of 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine?
The InChIKey is FZEFUZWFDOZUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-5-15-12-11(2)13(17-10-16-12)18-8-6-7-14(3,4)9-18/h10H,5-9H2,1-4H3,(H,15,16,17).
What are the key properties of 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine?
6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80835406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).