4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine

C14H24N6 — CID 99980092

IUPAC4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine
SMILESCc1cc(N2CCN(C)CC2)nc(N2CCNCC2)n1
InChIInChI=1S/C14H24N6/c1-12-11-13(19-9-7-18(2)8-10-19)17-14(16-12)20-5-3-15-4-6-20/h11,15H,3-10H2,1-2H3
InChIKeyVBEWPCGPNYDAJC-UHFFFAOYSA-N
MW276.39 g/mol
LogP-0.05
Rot. Bonds2

About 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine

4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine (PubChem CID 99980092) has the molecular formula C14H24N6 and a molecular weight of 276.39 g/mol. Its IUPAC name is 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine.

Molecular Properties

Compound Name4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine
PubChem CID99980092
Molecular FormulaC14H24N6
Molecular Weight276.39 g/mol
Exact Mass276.21
IUPAC Name4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine
SMILESCc1cc(N2CCN(C)CC2)nc(N2CCNCC2)n1
InChIInChI=1S/C14H24N6/c1-12-11-13(19-9-7-18(2)8-10-19)17-14(16-12)20-5-3-15-4-6-20/h11,15H,3-10H2,1-2H3
InChIKeyVBEWPCGPNYDAJC-UHFFFAOYSA-N
XLogP-0.05
TPSA47.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.39
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methyl-2-[4-[6-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]-1,3-thiazole
CID 165433029
2-[4-[6-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]benzonitrile
CID 171334663
4-methyl-6-(4-methylpiperazin-1-yl)-2-(4-propylsulfonylpiperazin-1-yl)pyrimidine
CID 27637479
5-fluoro-2-[4-[4-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]piperazin-1-yl]benzonitrile
CID 171334702
N,N-diethyl-4-(4-methylpiperazin-1-yl)-6-piperazin-1-ylpyrimidin-2-amine
CID 22418791
N,N-diethyl-4-methyl-6-piperazin-1-ylpyrimidin-2-amine
CID 83726827
ethane;4-[4-(4-methylpiperazin-1-yl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]piperazin-1-amine
CID 142530052
2-(4-chlorophenyl)-1-[4-[4-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]piperazin-1-yl]ethanone
CID 121032003
(E)-1-[4-[4-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]piperazin-1-yl]-3-phenylprop-2-en-1-one
CID 121031928
6-chloro-2-[4-[6-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl]quinoxaline
CID 166601989
6-chloro-2-[4-[4-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]piperazin-1-yl]quinoxaline
CID 166601988
(4-methyl-6-piperazin-1-ylpyrimidin-2-yl)hydrazine
CID 80917500

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine?
The IUPAC name of 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine (CID 99980092) is 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine.
What is the SMILES notation for 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine?
The canonical SMILES for 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine is Cc1cc(N2CCN(C)CC2)nc(N2CCNCC2)n1.
What is the InChIKey of 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine?
The InChIKey is VBEWPCGPNYDAJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6/c1-12-11-13(19-9-7-18(2)8-10-19)17-14(16-12)20-5-3-15-4-6-20/h11,15H,3-10H2,1-2H3.
What are the key properties of 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine?
4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine has a molecular weight of 276.39 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(4-methylpiperazin-1-yl)-2-piperazin-1-ylpyrimidine is sourced from PubChem (CID 99980092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).