2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine

C10H16N4 — CID 94587097

IUPAC2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine
SMILESCc1nccc(N2CCNC[C@H]2C)n1
InChIInChI=1S/C10H16N4/c1-8-7-11-5-6-14(8)10-3-4-12-9(2)13-10/h3-4,8,11H,5-7H2,1-2H3/t8-/m1/s1
InChIKeyVYHOCFYYVUJOHP-MRVPVSSYSA-N
MW192.27 g/mol
LogP0.58
Rot. Bonds1

About 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine

2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine (PubChem CID 94587097) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine.

Molecular Properties

Compound Name2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine
PubChem CID94587097
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine
SMILESCc1nccc(N2CCNC[C@H]2C)n1
InChIInChI=1S/C10H16N4/c1-8-7-11-5-6-14(8)10-3-4-12-9(2)13-10/h3-4,8,11H,5-7H2,1-2H3/t8-/m1/s1
InChIKeyVYHOCFYYVUJOHP-MRVPVSSYSA-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

2-chloro-4-[(2S)-2-methylpiperazin-1-yl]pyrimidine
CID 86329375
2-methyl-4-(2-phenylpiperazin-1-yl)pyrimidine
CID 110096847
2-methyl-1-(4-methyl-2-pyridinyl)piperazine;hydrochloride
CID 71639508
N,N-dimethyl-1-(2-methylpyrimidin-4-yl)piperazine-2-sulfonamide
CID 19883994
(2S)-1-(4-chloro-2-pyridinyl)-2-methylpiperazine
CID 96905168
(2R)-2-methyl-1-pyridin-2-ylpiperazine;hydrochloride
CID 134500587
ethane;2-methyl-4-piperazin-1-ylpyrimidine
CID 144746590
2-[(2S)-2-methylpiperazin-1-yl]-1,3-oxazole
CID 151453057
(2R)-1-(6-bromo-2-pyridinyl)-2-methylpiperazine
CID 97163339
1-(6-fluoro-2-pyridinyl)-2-methylpiperazine
CID 82670139
4-methoxy-2-(2-methylpiperazin-1-yl)pyrimidine
CID 62672840
(2S)-2-methyl-1-pyridin-4-ylpiperazine
CID 94546152

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine?
The IUPAC name of 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine (CID 94587097) is 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine.
What is the SMILES notation for 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine?
The canonical SMILES for 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine is Cc1nccc(N2CCNC[C@H]2C)n1.
What is the InChIKey of 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine?
The InChIKey is VYHOCFYYVUJOHP-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H16N4/c1-8-7-11-5-6-14(8)10-3-4-12-9(2)13-10/h3-4,8,11H,5-7H2,1-2H3/t8-/m1/s1.
What are the key properties of 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine?
2-methyl-4-[(2R)-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 2-methyl-4-[(2R)-2-methylpiperazin-1-yl]pyrimidine is sourced from PubChem (CID 94587097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).