2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine

C10H12N4 — CID 63810051

IUPAC2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine
SMILESCc1ccnc(-n2nc(C)cc2C)n1
InChIInChI=1S/C10H12N4/c1-7-4-5-11-10(12-7)14-9(3)6-8(2)13-14/h4-6H,1-3H3
InChIKeyAXYVVNGGPHICAI-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.59
Rot. Bonds1

About 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine

2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine (PubChem CID 63810051) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine
PubChem CID63810051
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine
SMILESCc1ccnc(-n2nc(C)cc2C)n1
InChIInChI=1S/C10H12N4/c1-7-4-5-11-10(12-7)14-9(3)6-8(2)13-14/h4-6H,1-3H3
InChIKeyAXYVVNGGPHICAI-UHFFFAOYSA-N
XLogP1.59
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5,7-Dimethyl(1,2,4)triazolo(1,5-a)pyrimidine
CID 24356
Pyrazolo(1,5-a)pyrimidine, 5,7-dimethyl-
CID 215186
Pyrazolo(1.5-a)pyrimidine, 5,7-dimethyl-3-iodo-
CID 206164
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine
CID 657722
5-amino-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazole-4-carbonitrile
CID 2317988
2-(3,5-Dimethyl-pyrazol-1-YL)-4,6-dimethyl-pyrimidine
CID 3401968
5-Methyl-s-triazolo(1,5-a)pyrimidine
CID 584230
3,5,7-trimethyl-3H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium
CID 3238460
4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methyl-1,3,5-triazin-2-amine
CID 785951
6-(3,5-dimethyl-1H-pyrazol-1-yl)-N,N'-diethyl-1,3,5-triazine-2,4-diamine
CID 785953
4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidin-2-amine
CID 742814
4,6-Bis(3,5-dimethyl-1H-pyrazole-1-yl)pyrimidine
CID 762995

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine (CID 63810051) is 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine is Cc1ccnc(-n2nc(C)cc2C)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine?
The InChIKey is AXYVVNGGPHICAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-7-4-5-11-10(12-7)14-9(3)6-8(2)13-14/h4-6H,1-3H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine?
2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine has a molecular weight of 188.23 g/mol, XLogP of 1.59, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-4-methylpyrimidine is sourced from PubChem (CID 63810051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).