1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride

C10H18Cl2N4 — CID 67342979

IUPAC1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride
SMILESCc1nccc(N2CCC(N)CC2)n1.Cl.Cl
InChIInChI=1S/C10H16N4.2ClH/c1-8-12-5-2-10(13-8)14-6-3-9(11)4-7-14;;/h2,5,9H,3-4,6-7,11H2,1H3;2*1H
InChIKeyFEKDASOZQKNRBF-UHFFFAOYSA-N
MW265.19 g/mol
LogP1.56
Rot. Bonds1

About 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride

1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride (PubChem CID 67342979) has the molecular formula C10H18Cl2N4 and a molecular weight of 265.19 g/mol. Its IUPAC name is 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride.

Molecular Properties

Compound Name1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride
PubChem CID67342979
Molecular FormulaC10H18Cl2N4
Molecular Weight265.19 g/mol
Exact Mass264.09
IUPAC Name1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride
SMILESCc1nccc(N2CCC(N)CC2)n1.Cl.Cl
InChIInChI=1S/C10H16N4.2ClH/c1-8-12-5-2-10(13-8)14-6-3-9(11)4-7-14;;/h2,5,9H,3-4,6-7,11H2,1H3;2*1H
InChIKeyFEKDASOZQKNRBF-UHFFFAOYSA-N
XLogP1.56
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.19
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride?
The IUPAC name of 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride (CID 67342979) is 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride.
What is the SMILES notation for 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride?
The canonical SMILES for 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride is Cc1nccc(N2CCC(N)CC2)n1.Cl.Cl.
What is the InChIKey of 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride?
The InChIKey is FEKDASOZQKNRBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4.2ClH/c1-8-12-5-2-10(13-8)14-6-3-9(11)4-7-14;;/h2,5,9H,3-4,6-7,11H2,1H3;2*1H.
What are the key properties of 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride?
1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride has a molecular weight of 265.19 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrimidin-4-yl)piperidin-4-amine;dihydrochloride is sourced from PubChem (CID 67342979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).