6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine

C17H30N4 — CID 80984837

IUPAC6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(N)nc(C(C)C)nc1N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C17H30N4/c1-11(2)15-19-14(18)12(3)16(20-15)21-9-7-13(8-10-21)17(4,5)6/h11,13H,7-10H2,1-6H3,(H2,18,19,20)
InChIKeyLOVOMANDVNNLNN-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.75
Rot. Bonds2

About 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine

6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 80984837) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID80984837
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC Name6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(N)nc(C(C)C)nc1N1CCC(C(C)(C)C)CC1
InChIInChI=1S/C17H30N4/c1-11(2)15-19-14(18)12(3)16(20-15)21-9-7-13(8-10-21)17(4,5)6/h11,13H,7-10H2,1-6H3,(H2,18,19,20)
InChIKeyLOVOMANDVNNLNN-UHFFFAOYSA-N
XLogP3.75
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-2-propan-2-yl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 80982123
5-methyl-6-piperazin-1-yl-2-propan-2-ylpyrimidin-4-amine
CID 80983579
1-(6-amino-5-methyl-2-propan-2-ylpyrimidin-4-yl)pyrrolidine-3,4-diol
CID 106674605
5-methyl-2-propan-2-yl-6-(1,4-thiazepan-4-yl)pyrimidin-4-amine
CID 80986492
[1-(6-amino-5-methyl-2-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methanol
CID 80993933
6-[3-(methoxymethyl)piperidin-1-yl]-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 106590122
4-(4-tert-butylpiperidin-1-yl)-6-chloro-2,5-dimethylpyrimidine
CID 55230084
6-(4-tert-butylpiperidin-1-yl)-5-methylpyridin-3-amine
CID 62475559
6-(2-ethyl-5-methylpyrrolidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 83223748
5-(4-tert-butylpiperidin-1-yl)-4-methyl-1,2-thiazol-3-amine
CID 103360617
N,5-dimethyl-6-(4-methylpiperidin-1-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80981572
4-chloro-6-(4-ethylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidine
CID 80970665

Frequently Asked Questions

What is the IUPAC name of 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine (CID 80984837) is 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine is Cc1c(N)nc(C(C)C)nc1N1CCC(C(C)(C)C)CC1.
What is the InChIKey of 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is LOVOMANDVNNLNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-11(2)15-19-14(18)12(3)16(20-15)21-9-7-13(8-10-21)17(4,5)6/h11,13H,7-10H2,1-6H3,(H2,18,19,20).
What are the key properties of 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 290.45 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-tert-butylpiperidin-1-yl)-5-methyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80984837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).