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

C10H16N4 — CID 82669790

IUPAC4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine
SMILESCc1ncncc1N1CCNCC1C
InChIInChI=1S/C10H16N4/c1-8-5-11-3-4-14(8)10-6-12-7-13-9(10)2/h6-8,11H,3-5H2,1-2H3
InChIKeyNCXNZRRIQHQNGR-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.58
Rot. Bonds1

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

4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine (PubChem CID 82669790) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine.

Molecular Properties

Compound Name4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine
PubChem CID82669790
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine
SMILESCc1ncncc1N1CCNCC1C
InChIInChI=1S/C10H16N4/c1-8-5-11-3-4-14(8)10-6-12-7-13-9(10)2/h6-8,11H,3-5H2,1-2H3
InChIKeyNCXNZRRIQHQNGR-UHFFFAOYSA-N
XLogP0.58
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-(2-methylpiperazin-1-yl)pyrimidine
CID 66340193
2-(2-methylpiperazin-1-yl)pyrimidin-5-ol
CID 67037782
(2S)-2-methyl-1-pyridin-4-ylpiperazine
CID 94546152
3,4-dimethyl-5-(2-methylpiperazin-1-yl)-1,2-oxazole
CID 82670180
2-chloro-6-(2-methylpiperazin-1-yl)pyrazine
CID 18186773
2-[(2S)-2-methylpiperazin-1-yl]-1,3-oxazole
CID 151453057
4-chloro-5-methyl-2-[(2R)-2-methylpiperazin-1-yl]pyrimidine
CID 86329330
2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine
CID 94587097
1-(2,5-difluoro-4-methylphenyl)-2-methylpiperazine
CID 103587648
5-cyclobutyl-2-(2-methylpiperazin-1-yl)pyrimidine
CID 116976419
5-ethenyl-2-[(2S)-2-methylpiperazin-1-yl]pyrimidine
CID 89340460
(2R)-1-(2-chloro-4-methylphenyl)-2-methylpiperazine
CID 96808511

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine?
The IUPAC name of 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine (CID 82669790) is 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine.
What is the SMILES notation for 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine?
The canonical SMILES for 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine is Cc1ncncc1N1CCNCC1C.
What is the InChIKey of 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine?
The InChIKey is NCXNZRRIQHQNGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-8-5-11-3-4-14(8)10-6-12-7-13-9(10)2/h6-8,11H,3-5H2,1-2H3.
What are the key properties of 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine?
4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine has a molecular weight of 192.27 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine is sourced from PubChem (CID 82669790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).