2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine

C11H14N4 — CID 3401968

IUPAC2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine
SMILESCc1cc(C)nc(-n2nc(C)cc2C)n1
InChIInChI=1S/C11H14N4/c1-7-5-8(2)13-11(12-7)15-10(4)6-9(3)14-15/h5-6H,1-4H3
InChIKeyHZNGLSIEGWQEIB-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.90
Rot. Bonds1

About 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine

2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine (PubChem CID 3401968) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine
PubChem CID3401968
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine
SMILESCc1cc(C)nc(-n2nc(C)cc2C)n1
InChIInChI=1S/C11H14N4/c1-7-5-8(2)13-11(12-7)15-10(4)6-9(3)14-15/h5-6H,1-4H3
InChIKeyHZNGLSIEGWQEIB-UHFFFAOYSA-N
XLogP1.90
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.90
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
Cyclohexyl-(2-(3,5-dimethylpyrazol-1-yl)-6-methylpyrimidin-4-yl)amine
CID 909822
5,7-Dimethyl(1,2,4)triazolo(1,5-a)pyrimidine-2-propanol
CID 4885555
5,7-Dimethyltetrazolo(1,5-a)pyrimidine
CID 229014
4-chloro-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidine
CID 911195
2-(3,5-dimethyl-1H-pyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine
CID 657722
5,7-Dimethylpyrazolo[1,5-a]pyrimidin-2-amine
CID 28063903
4,6-dimethyl-N-(5-methyl-4H-1,2,4-triazol-3-yl)pyrimidin-2-amine
CID 1512122
6-(3,5-Dimethyl-pyrazol-1-yl)-N,N'-diisopropyl-[1,3,5]triazine-2,4-diamine
CID 655127
5,7-Dimethyl-(1,2,4)triazolo(1,5-a)pyrimidin-2-amine
CID 267310
2,5,7-Trimethylpyrazolo[1,5-a]pyrimidine
CID 3611062
3,5,7-trimethyl-3H-[1,2,4]triazolo[1,5-a]pyrimidin-8-ium
CID 3238460

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine (CID 3401968) is 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine is Cc1cc(C)nc(-n2nc(C)cc2C)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine?
The InChIKey is HZNGLSIEGWQEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-7-5-8(2)13-11(12-7)15-10(4)6-9(3)14-15/h5-6H,1-4H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine?
2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethylpyrimidine has a molecular weight of 202.26 g/mol, XLogP of 1.90, 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)-4,6-dimethylpyrimidine is sourced from PubChem (CID 3401968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).