2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride

C10H18Cl2N4 — CID 67373203

IUPAC2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride
SMILESCc1nccc(NC2CCNCC2)n1.Cl.Cl
InChIInChI=1S/C10H16N4.2ClH/c1-8-12-7-4-10(13-8)14-9-2-5-11-6-3-9;;/h4,7,9,11H,2-3,5-6H2,1H3,(H,12,13,14);2*1H
InChIKeyMFDHBAUEBWKESS-UHFFFAOYSA-N
MW265.19 g/mol
LogP1.79
Rot. Bonds2

About 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride

2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride (PubChem CID 67373203) has the molecular formula C10H18Cl2N4 and a molecular weight of 265.19 g/mol. Its IUPAC name is 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride.

Molecular Properties

Compound Name2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride
PubChem CID67373203
Molecular FormulaC10H18Cl2N4
Molecular Weight265.19 g/mol
Exact Mass264.09
IUPAC Name2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride
SMILESCc1nccc(NC2CCNCC2)n1.Cl.Cl
InChIInChI=1S/C10H16N4.2ClH/c1-8-12-7-4-10(13-8)14-9-2-5-11-6-3-9;;/h4,7,9,11H,2-3,5-6H2,1H3,(H,12,13,14);2*1H
InChIKeyMFDHBAUEBWKESS-UHFFFAOYSA-N
XLogP1.79
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.19
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride?
The IUPAC name of 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride (CID 67373203) is 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride.
What is the SMILES notation for 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride?
The canonical SMILES for 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride is Cc1nccc(NC2CCNCC2)n1.Cl.Cl.
What is the InChIKey of 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride?
The InChIKey is MFDHBAUEBWKESS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4.2ClH/c1-8-12-7-4-10(13-8)14-9-2-5-11-6-3-9;;/h4,7,9,11H,2-3,5-6H2,1H3,(H,12,13,14);2*1H.
What are the key properties of 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride?
2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride has a molecular weight of 265.19 g/mol, XLogP of 1.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride is sourced from PubChem (CID 67373203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).