5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride

C10H18Cl2N4 — CID 171333757

IUPAC5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride
SMILESCc1cnc(N2CCN(C)CC2)nc1.Cl.Cl
InChIInChI=1S/C10H16N4.2ClH/c1-9-7-11-10(12-8-9)14-5-3-13(2)4-6-14;;/h7-8H,3-6H2,1-2H3;2*1H
InChIKeyPKPXEQODEYFGNR-UHFFFAOYSA-N
MW265.19 g/mol
LogP1.38
Rot. Bonds1

About 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride

5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride (PubChem CID 171333757) has the molecular formula C10H18Cl2N4 and a molecular weight of 265.19 g/mol. Its IUPAC name is 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride.

Molecular Properties

Compound Name5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride
PubChem CID171333757
Molecular FormulaC10H18Cl2N4
Molecular Weight265.19 g/mol
Exact Mass264.09
IUPAC Name5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride
SMILESCc1cnc(N2CCN(C)CC2)nc1.Cl.Cl
InChIInChI=1S/C10H16N4.2ClH/c1-9-7-11-10(12-8-9)14-5-3-13(2)4-6-14;;/h7-8H,3-6H2,1-2H3;2*1H
InChIKeyPKPXEQODEYFGNR-UHFFFAOYSA-N
XLogP1.38
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.19
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-Methylpyrimidine
CID 74859
4-N-(2,2-dimethylpropyl)-5-methylpyrimidine-2,4-diamine
CID 80798438
4-N-(2,2-dimethylpropyl)-4-N,5-dimethylpyrimidine-2,4-diamine
CID 80818780
2-Chloro-5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidine
CID 1714310
2-Chloro-5-methylpyrimidine
CID 581719
5-Methyl-4-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 25130908
Pyrimidine, 2-chloro-4-(dimethylamino)-5-methyl-
CID 214763
2-[4-(Propan-2-yl)piperazin-1-yl]pyrimidine
CID 13375504
5-Fluoro-2-(piperazin-1-yl)pyrimidine
CID 10058158
5-{[Ethyl(methyl)amino]methyl}-2-methyl-5,6-dihydropyrimidin-4-amine
CID 448672
2-Chloro-4-(4-methylpiperazin-1-yl)pyrimidine
CID 1714225
2,5-Dimethylpyrimidine
CID 535856

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride?
The IUPAC name of 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride (CID 171333757) is 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride.
What is the SMILES notation for 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride?
The canonical SMILES for 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride is Cc1cnc(N2CCN(C)CC2)nc1.Cl.Cl.
What is the InChIKey of 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride?
The InChIKey is PKPXEQODEYFGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4.2ClH/c1-9-7-11-10(12-8-9)14-5-3-13(2)4-6-14;;/h7-8H,3-6H2,1-2H3;2*1H.
What are the key properties of 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride?
5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride has a molecular weight of 265.19 g/mol, XLogP of 1.38, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride is sourced from PubChem (CID 171333757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).