2-methyl-5-(4-methyloctan-4-yl)pyrimidine

C14H24N2 — CID 130337188

IUPAC2-methyl-5-(4-methyloctan-4-yl)pyrimidine
SMILESCCCCC(C)(CCC)c1cnc(C)nc1
InChIInChI=1S/C14H24N2/c1-5-7-9-14(4,8-6-2)13-10-15-12(3)16-11-13/h10-11H,5-9H2,1-4H3
InChIKeyULSKIEGYCVQXDF-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.03
Rot. Bonds6

About 2-methyl-5-(4-methyloctan-4-yl)pyrimidine

2-methyl-5-(4-methyloctan-4-yl)pyrimidine (PubChem CID 130337188) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-methyl-5-(4-methyloctan-4-yl)pyrimidine.

Molecular Properties

Compound Name2-methyl-5-(4-methyloctan-4-yl)pyrimidine
PubChem CID130337188
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name2-methyl-5-(4-methyloctan-4-yl)pyrimidine
SMILESCCCCC(C)(CCC)c1cnc(C)nc1
InChIInChI=1S/C14H24N2/c1-5-7-9-14(4,8-6-2)13-10-15-12(3)16-11-13/h10-11H,5-9H2,1-4H3
InChIKeyULSKIEGYCVQXDF-UHFFFAOYSA-N
XLogP4.03
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-methylheptan-4-yl)-2-(4-methyloctan-4-yl)pyrimidine
CID 123451996
5-(1,1-difluorobutyl)-2-methylpyrimidine
CID 177243593
3-(5-methylnonan-5-yl)pyridine
CID 139543665
2-(5-methylundecan-5-yl)-1,3-oxazole
CID 146378601
4-(5-methylundecan-5-yl)-1H-pyrazole
CID 139543634
2-methyl-5-(2-methyloctan-2-yloxy)pyrimidine
CID 130337407
5-methyl-3-(4-methyloctan-4-yl)-1,2-thiazole
CID 146378474
4-(5-methylundecan-5-yl)pyridine
CID 146178387
2-fluoro-4-(4-methyldecan-4-yl)pyridine
CID 166909360
5-(4-methyldecan-4-yl)-1,3-thiazole
CID 167193600
5-fluoro-4-(4-methyloctan-4-yl)-1,2-thiazole
CID 146378502
1-methyl-4-(5-methylnonan-5-yl)benzene;5-methylnonan-5-ol
CID 159636901

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(4-methyloctan-4-yl)pyrimidine?
The IUPAC name of 2-methyl-5-(4-methyloctan-4-yl)pyrimidine (CID 130337188) is 2-methyl-5-(4-methyloctan-4-yl)pyrimidine.
What is the SMILES notation for 2-methyl-5-(4-methyloctan-4-yl)pyrimidine?
The canonical SMILES for 2-methyl-5-(4-methyloctan-4-yl)pyrimidine is CCCCC(C)(CCC)c1cnc(C)nc1.
What is the InChIKey of 2-methyl-5-(4-methyloctan-4-yl)pyrimidine?
The InChIKey is ULSKIEGYCVQXDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-5-7-9-14(4,8-6-2)13-10-15-12(3)16-11-13/h10-11H,5-9H2,1-4H3.
What are the key properties of 2-methyl-5-(4-methyloctan-4-yl)pyrimidine?
2-methyl-5-(4-methyloctan-4-yl)pyrimidine has a molecular weight of 220.36 g/mol, XLogP of 4.03, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(4-methyloctan-4-yl)pyrimidine is sourced from PubChem (CID 130337188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).