[1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine

C11H18N4 — CID 83820134

IUPAC[1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine
SMILESCc1ncc(N2CCC(CN)CC2)cn1
InChIInChI=1S/C11H18N4/c1-9-13-7-11(8-14-9)15-4-2-10(6-12)3-5-15/h7-8,10H,2-6,12H2,1H3
InChIKeySSIXBBVWELPJHF-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.96
Rot. Bonds2

About [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine

[1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine (PubChem CID 83820134) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine
PubChem CID83820134
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name[1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine
SMILESCc1ncc(N2CCC(CN)CC2)cn1
InChIInChI=1S/C11H18N4/c1-9-13-7-11(8-14-9)15-4-2-10(6-12)3-5-15/h7-8,10H,2-6,12H2,1H3
InChIKeySSIXBBVWELPJHF-UHFFFAOYSA-N
XLogP0.96
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine
CID 112709497
(1-pyrazin-2-ylpiperidin-4-yl)methanamine;dihydrochloride
CID 56965638
[1-(3-methyltriazol-4-yl)piperidin-4-yl]methanamine
CID 130486423
[1-(1-methylimidazol-2-yl)piperidin-4-yl]methanamine
CID 62132388
[1-(6-ethoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methanamine
CID 66327389
[1-[(5-methyl-2-pyridinyl)methyl]piperidin-4-yl]methanamine
CID 81312464
(1-pyridin-2-ylpiperidin-4-yl)methanamine;dihydrochloride
CID 140971287
[1-(1,2,4-triazin-6-yl)piperidin-4-yl]methanamine
CID 112709666
2-[4-(aminomethyl)piperidin-1-yl]pyridin-3-ol
CID 71644858
[1-(2-methyl-3-pyridinyl)pyrrolidin-3-yl]methanamine
CID 79044078
[(3R)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]methanamine
CID 94342238
1-(2-cyclobutylpyrimidin-5-yl)piperidin-4-amine
CID 117212262

Frequently Asked Questions

What is the IUPAC name of [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine?
The IUPAC name of [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine (CID 83820134) is [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine.
What is the SMILES notation for [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine?
The canonical SMILES for [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine is Cc1ncc(N2CCC(CN)CC2)cn1.
What is the InChIKey of [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine?
The InChIKey is SSIXBBVWELPJHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-9-13-7-11(8-14-9)15-4-2-10(6-12)3-5-15/h7-8,10H,2-6,12H2,1H3.
What are the key properties of [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine?
[1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine has a molecular weight of 206.29 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine is sourced from PubChem (CID 83820134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).