4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine

C11H14Cl2N2 — CID 130805079

IUPAC4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine
SMILESCC1CCCCC1c1nc(Cl)cc(Cl)n1
InChIInChI=1S/C11H14Cl2N2/c1-7-4-2-3-5-8(7)11-14-9(12)6-10(13)15-11/h6-8H,2-5H2,1H3
InChIKeyHLUGKOVDIJTJCY-UHFFFAOYSA-N
MW245.15 g/mol
LogP4.08
Rot. Bonds1

About 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine

4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine (PubChem CID 130805079) has the molecular formula C11H14Cl2N2 and a molecular weight of 245.15 g/mol. Its IUPAC name is 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine.

Molecular Properties

Compound Name4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine
PubChem CID130805079
Molecular FormulaC11H14Cl2N2
Molecular Weight245.15 g/mol
Exact Mass244.05
IUPAC Name4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine
SMILESCC1CCCCC1c1nc(Cl)cc(Cl)n1
InChIInChI=1S/C11H14Cl2N2/c1-7-4-2-3-5-8(7)11-14-9(12)6-10(13)15-11/h6-8H,2-5H2,1H3
InChIKeyHLUGKOVDIJTJCY-UHFFFAOYSA-N
XLogP4.08
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.15
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4,6-dichloro-2-cycloundecylpyrimidine
CID 123163685
6-chloro-2-cyclopropyl-N-methyl-N-(2-methylcyclohexyl)pyrimidin-4-amine
CID 80953380
4-chloro-2-(2-methylcyclopropyl)-6-phenylpyrimidine
CID 65422322
5-methyl-3-(2-methylcyclohexyl)-1,2,4-oxadiazole
CID 126993675
4-chloro-2-methyl-6-(2-methylcyclohexyl)oxypyrimidine
CID 62483757
7-chloro-5-[(1R,2R)-2-methylcyclohexyl]pyrazolo[1,5-a]pyrimidine
CID 129393998
4-chloro-2-cycloheptyl-6-cyclopentylpyrimidine
CID 113390255
5-(2-chloroethyl)-3-(2-methylcyclohexyl)-1,2,4-oxadiazole
CID 131071191
6-chloro-N,2-dimethyl-N-(2-methylcyclohexyl)pyrimidin-4-amine
CID 62483372
4-chloro-2-(2-methylcyclopropyl)-6-(1-methylpyrazol-4-yl)pyrimidine
CID 106715389
4,6-dichloro-2-[(2S)-2-methylpyrrolidin-1-yl]pyrimidine
CID 59168274
4,6-dichloro-2-pyrrolidin-2-ylpyrimidine;hydrochloride
CID 155895891

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine?
The IUPAC name of 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine (CID 130805079) is 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine.
What is the SMILES notation for 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine?
The canonical SMILES for 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine is CC1CCCCC1c1nc(Cl)cc(Cl)n1.
What is the InChIKey of 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine?
The InChIKey is HLUGKOVDIJTJCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2/c1-7-4-2-3-5-8(7)11-14-9(12)6-10(13)15-11/h6-8H,2-5H2,1H3.
What are the key properties of 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine?
4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine has a molecular weight of 245.15 g/mol, XLogP of 4.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-2-(2-methylcyclohexyl)pyrimidine is sourced from PubChem (CID 130805079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).