1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine

C12H20N4 — CID 63255605

IUPAC1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine
SMILESCc1cnc(N2CCCCC2C(C)N)nc1
InChIInChI=1S/C12H20N4/c1-9-7-14-12(15-8-9)16-6-4-3-5-11(16)10(2)13/h7-8,10-11H,3-6,13H2,1-2H3
InChIKeyLRSXURHPKGHGBT-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.49
Rot. Bonds2

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

1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine (PubChem CID 63255605) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine
PubChem CID63255605
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine
SMILESCc1cnc(N2CCCCC2C(C)N)nc1
InChIInChI=1S/C12H20N4/c1-9-7-14-12(15-8-9)16-6-4-3-5-11(16)10(2)13/h7-8,10-11H,3-6,13H2,1-2H3
InChIKeyLRSXURHPKGHGBT-UHFFFAOYSA-N
XLogP1.49
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(1-aminoethyl)piperidin-1-yl]pyrimidine-4-carbonitrile
CID 107552500
1-[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-2-yl]ethanamine
CID 115973416
1-[1-(6-methylthieno[2,3-d]pyrimidin-4-yl)piperidin-2-yl]ethanamine
CID 63617392
1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine
CID 66333682
1-[1-(6-ethylpyrimidin-4-yl)piperidin-2-yl]ethanamine
CID 63256097
N-ethyl-1-[1-(5-fluoropyrimidin-2-yl)piperidin-2-yl]ethanamine
CID 104605826
1-[1-(4,5-dihydro-1H-imidazol-2-yl)piperidin-2-yl]ethanamine
CID 114400507
1-[1-(4-methyl-2-nitrophenyl)piperidin-2-yl]ethanamine
CID 63255659
N-[1-[1-(5-fluoropyrimidin-2-yl)piperidin-2-yl]ethyl]propan-1-amine
CID 104605827
3-[1-(5-methylpyrimidin-2-yl)pyrrolidin-2-yl]propan-1-amine
CID 63761067
1-[1-(6-methyl-3-nitro-2-pyridinyl)piperidin-2-yl]ethanamine
CID 81136189
3-[2-(1-aminoethyl)piperidin-1-yl]-1-tert-butylpyrazin-2-one
CID 63255696

Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine?
The IUPAC name of 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine (CID 63255605) is 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine.
What is the SMILES notation for 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine?
The canonical SMILES for 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine is Cc1cnc(N2CCCCC2C(C)N)nc1.
What is the InChIKey of 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine?
The InChIKey is LRSXURHPKGHGBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9-7-14-12(15-8-9)16-6-4-3-5-11(16)10(2)13/h7-8,10-11H,3-6,13H2,1-2H3.
What are the key properties of 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine?
1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine has a molecular weight of 220.32 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine is sourced from PubChem (CID 63255605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).