2-methyl-4-(3-methylbutyl)pyrimidine

C10H16N2 — CID 143330492

IUPAC2-methyl-4-(3-methylbutyl)pyrimidine
SMILESCc1nccc(CCC(C)C)n1
InChIInChI=1S/C10H16N2/c1-8(2)4-5-10-6-7-11-9(3)12-10/h6-8H,4-5H2,1-3H3
InChIKeyJFUYGLFEZQAKLA-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.37
Rot. Bonds3

About 2-methyl-4-(3-methylbutyl)pyrimidine

2-methyl-4-(3-methylbutyl)pyrimidine (PubChem CID 143330492) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 2-methyl-4-(3-methylbutyl)pyrimidine.

Molecular Properties

Compound Name2-methyl-4-(3-methylbutyl)pyrimidine
PubChem CID143330492
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name2-methyl-4-(3-methylbutyl)pyrimidine
SMILESCc1nccc(CCC(C)C)n1
InChIInChI=1S/C10H16N2/c1-8(2)4-5-10-6-7-11-9(3)12-10/h6-8H,4-5H2,1-3H3
InChIKeyJFUYGLFEZQAKLA-UHFFFAOYSA-N
XLogP2.37
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-chloroethyl)-2-methylpyrimidine
CID 115529496
2-(2-methylpyrimidin-4-yl)ethanamine;hydrochloride
CID 129319573
7-methyl-N-[(2-methylpyrimidin-4-yl)methyl]octan-1-amine
CID 62747506
4-(2-chloro-3-methylbutyl)-2-methylpyrimidine
CID 63203137
N-ethyl-2-(2-methylpyrimidin-4-yl)ethanamine
CID 115529481
2-(3-methylbutyl)-4-propan-2-ylpyridine
CID 59202153
2-[2-methylpropyl-[(2-methylpyrimidin-4-yl)methyl]amino]acetic acid
CID 115529611
1-[2-(3-methylbutyl)pyrimidin-4-yl]propan-2-amine
CID 62745394
4-(2-bromobutyl)-2-methylpyrimidine
CID 63203331
[6-(3-methylbutyl)-2-pyridinyl]methanamine
CID 54541845
1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine
CID 63200567
4-(2-bromo-3,3-dimethylbutyl)-2-methylpyrimidine
CID 63203324

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(3-methylbutyl)pyrimidine?
The IUPAC name of 2-methyl-4-(3-methylbutyl)pyrimidine (CID 143330492) is 2-methyl-4-(3-methylbutyl)pyrimidine.
What is the SMILES notation for 2-methyl-4-(3-methylbutyl)pyrimidine?
The canonical SMILES for 2-methyl-4-(3-methylbutyl)pyrimidine is Cc1nccc(CCC(C)C)n1.
What is the InChIKey of 2-methyl-4-(3-methylbutyl)pyrimidine?
The InChIKey is JFUYGLFEZQAKLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8(2)4-5-10-6-7-11-9(3)12-10/h6-8H,4-5H2,1-3H3.
What are the key properties of 2-methyl-4-(3-methylbutyl)pyrimidine?
2-methyl-4-(3-methylbutyl)pyrimidine has a molecular weight of 164.25 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(3-methylbutyl)pyrimidine is sourced from PubChem (CID 143330492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).