5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one

C11H18N4O — CID 117211358

IUPAC5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one
SMILESCCc1[nH]c(=O)ncc1N1CCC(N)CC1
InChIInChI=1S/C11H18N4O/c1-2-9-10(7-13-11(16)14-9)15-5-3-8(12)4-6-15/h7-8H,2-6,12H2,1H3,(H,13,14,16)
InChIKeyQNWASNXDUQSRHC-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.26
Rot. Bonds2

About 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one

5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one (PubChem CID 117211358) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one.

Molecular Properties

Compound Name5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one
PubChem CID117211358
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one
SMILESCCc1[nH]c(=O)ncc1N1CCC(N)CC1
InChIInChI=1S/C11H18N4O/c1-2-9-10(7-13-11(16)14-9)15-5-3-8(12)4-6-15/h7-8H,2-6,12H2,1H3,(H,13,14,16)
InChIKeyQNWASNXDUQSRHC-UHFFFAOYSA-N
XLogP0.26
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-aminopiperidin-1-yl)-6-(4-methoxyphenyl)-1H-pyrimidin-2-one
CID 117211273
1-[4-ethyl-2-(4-methylphenyl)pyrimidin-5-yl]piperidin-4-amine
CID 117212039
6-[2-(3,5-diamino-6-bromopyrazin-2-yl)-2-oxoethyl]-5-(4-fluoropiperidin-1-yl)-1H-pyrimidin-2-one
CID 147249806
1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine
CID 117212011
1-(4-cyclopentyl-2-ethylpyrimidin-5-yl)piperidin-4-amine
CID 117211578
2-(4-aminopiperidin-1-yl)-4-ethyl-1H-pyrimidin-6-one
CID 136740823
1-(5-ethyl-1H-pyrazol-4-yl)piperidine-4-carboxylic acid
CID 165469091
1-(3-ethyl-1-methylpyrazol-4-yl)piperidin-4-amine
CID 107463343
1-(2-tert-butyl-4-cyclobutylpyrimidin-5-yl)piperidin-4-amine
CID 117211511
3-(4-aminopiperidin-1-yl)-4H-1,2,4-triazin-5-one;hydrochloride
CID 137091118
1-[2-(4-fluorophenyl)-4-methylpyrimidin-5-yl]piperidin-4-amine
CID 117212294
1-[2-methyl-4-(4-methylphenyl)pyrimidin-5-yl]piperidin-4-amine
CID 117211255

Frequently Asked Questions

What is the IUPAC name of 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one?
The IUPAC name of 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one (CID 117211358) is 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one.
What is the SMILES notation for 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one?
The canonical SMILES for 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one is CCc1[nH]c(=O)ncc1N1CCC(N)CC1.
What is the InChIKey of 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one?
The InChIKey is QNWASNXDUQSRHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-2-9-10(7-13-11(16)14-9)15-5-3-8(12)4-6-15/h7-8H,2-6,12H2,1H3,(H,13,14,16).
What are the key properties of 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one?
5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one has a molecular weight of 222.29 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-aminopiperidin-1-yl)-6-ethyl-1H-pyrimidin-2-one is sourced from PubChem (CID 117211358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).