4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine

C14H24N4 — CID 80767776

IUPAC4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine
SMILESCCNc1ncc(C)c(N2CC(C)CC(C)C2)n1
InChIInChI=1S/C14H24N4/c1-5-15-14-16-7-12(4)13(17-14)18-8-10(2)6-11(3)9-18/h7,10-11H,5-6,8-9H2,1-4H3,(H,15,16,17)
InChIKeyYDYMXATUYXSLQQ-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.70
Rot. Bonds3

About 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine

4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine (PubChem CID 80767776) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine
PubChem CID80767776
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine
SMILESCCNc1ncc(C)c(N2CC(C)CC(C)C2)n1
InChIInChI=1S/C14H24N4/c1-5-15-14-16-7-12(4)13(17-14)18-8-10(2)6-11(3)9-18/h7,10-11H,5-6,8-9H2,1-4H3,(H,15,16,17)
InChIKeyYDYMXATUYXSLQQ-UHFFFAOYSA-N
XLogP2.70
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 ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(ethylamino)-5-methylpyrimidin-4-yl]-4-methylpiperidin-3-ol
CID 102971036
N-ethyl-5-methyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyrimidin-2-amine
CID 80827968
4-(4,4-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine
CID 80824282
5-bromo-4-(3,5-dimethylpiperidin-1-yl)-N-propylpyrimidin-2-amine
CID 80767611
5-methyl-N-propyl-4-(3,4,5-trimethylpiperazin-1-yl)pyrimidin-2-amine
CID 114541868
N-ethyl-4-(4-ethylazepan-1-yl)-5-methylpyrimidin-2-amine
CID 80837924
N-ethyl-5-methyl-4-(3,4,5-trimethylpyrazol-1-yl)pyrimidin-2-amine
CID 80857593
1-[2-(ethylamino)-5-methylpyrimidin-4-yl]piperidine-3-carboxamide
CID 80756566
5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine
CID 80764781
[5-methyl-4-(3-methylpyrrolidin-1-yl)pyrimidin-2-yl]hydrazine
CID 80899468
4-[2-(ethylamino)-5-methylpyrimidin-4-yl]-1-methyl-1,4-diazepan-2-one
CID 102887788
[1-[2-(ethylamino)-5-methylpyrimidin-4-yl]-3-methylpyrrolidin-2-yl]methanol
CID 102789926

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine?
The IUPAC name of 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine (CID 80767776) is 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine.
What is the SMILES notation for 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine?
The canonical SMILES for 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine is CCNc1ncc(C)c(N2CC(C)CC(C)C2)n1.
What is the InChIKey of 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine?
The InChIKey is YDYMXATUYXSLQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-5-15-14-16-7-12(4)13(17-14)18-8-10(2)6-11(3)9-18/h7,10-11H,5-6,8-9H2,1-4H3,(H,15,16,17).
What are the key properties of 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine?
4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine has a molecular weight of 248.37 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-2-amine is sourced from PubChem (CID 80767776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).