1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol

C16H28N4O — CID 114683989

IUPAC1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol
SMILESCCCc1nc(NCC)c(C)c(N2CCC(O)C(C)C2)n1
InChIInChI=1S/C16H28N4O/c1-5-7-14-18-15(17-6-2)12(4)16(19-14)20-9-8-13(21)11(3)10-20/h11,13,21H,5-10H2,1-4H3,(H,17,18,19)
InChIKeySJRXNCXWUHLRLO-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.38
Rot. Bonds5

About 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol

1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol (PubChem CID 114683989) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol
PubChem CID114683989
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol
SMILESCCCc1nc(NCC)c(C)c(N2CCC(O)C(C)C2)n1
InChIInChI=1S/C16H28N4O/c1-5-7-14-18-15(17-6-2)12(4)16(19-14)20-9-8-13(21)11(3)10-20/h11,13,21H,5-10H2,1-4H3,(H,17,18,19)
InChIKeySJRXNCXWUHLRLO-UHFFFAOYSA-N
XLogP2.38
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]-3-methylpiperidin-4-ol
CID 114683955
1-[5-methyl-2-propyl-6-(propylamino)pyrimidin-4-yl]piperidin-4-ol
CID 80981249
N-ethyl-5-methyl-6-(2-methyl-1,4-oxazepan-4-yl)-2-propylpyrimidin-4-amine
CID 80985308
[1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpyrrolidin-2-yl]methanol
CID 102789896
1-[6-(ethylamino)-5-methylpyrimidin-4-yl]-4-methylpiperidin-3-ol
CID 102971284
1-[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-3-methylpiperidin-4-ol
CID 114683985
1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]piperidin-4-ol
CID 80764591
N-ethyl-5-methyl-6-(3-methylmorpholin-4-yl)-2-propylpyrimidin-4-amine
CID 80993713
2-tert-butyl-N-ethyl-5-methyl-6-(3-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80986307
[1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]pyrrolidin-3-yl]methanol
CID 112629574
6-(3-cyclopropylpyrazol-1-yl)-N-ethyl-5-methyl-2-propylpyrimidin-4-amine
CID 80987997
6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine
CID 80984787

Frequently Asked Questions

What is the IUPAC name of 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol?
The IUPAC name of 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol (CID 114683989) is 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol?
The canonical SMILES for 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol is CCCc1nc(NCC)c(C)c(N2CCC(O)C(C)C2)n1.
What is the InChIKey of 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol?
The InChIKey is SJRXNCXWUHLRLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-5-7-14-18-15(17-6-2)12(4)16(19-14)20-9-8-13(21)11(3)10-20/h11,13,21H,5-10H2,1-4H3,(H,17,18,19).
What are the key properties of 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol?
1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol has a molecular weight of 292.43 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol is sourced from PubChem (CID 114683989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).