2-methyl-5-(4-methylcyclohexyl)pyrazine

C12H18N2 — CID 23588709

IUPAC2-methyl-5-(4-methylcyclohexyl)pyrazine
SMILESCc1cnc(C2CCC(C)CC2)cn1
InChIInChI=1S/C12H18N2/c1-9-3-5-11(6-4-9)12-8-13-10(2)7-14-12/h7-9,11H,3-6H2,1-2H3
InChIKeyKOBJFTPSTXMGAB-UHFFFAOYSA-N
MW190.29 g/mol
LogP3.08
Rot. Bonds1

About 2-methyl-5-(4-methylcyclohexyl)pyrazine

2-methyl-5-(4-methylcyclohexyl)pyrazine (PubChem CID 23588709) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-methyl-5-(4-methylcyclohexyl)pyrazine.

Molecular Properties

Compound Name2-methyl-5-(4-methylcyclohexyl)pyrazine
PubChem CID23588709
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-methyl-5-(4-methylcyclohexyl)pyrazine
SMILESCc1cnc(C2CCC(C)CC2)cn1
InChIInChI=1S/C12H18N2/c1-9-3-5-11(6-4-9)12-8-13-10(2)7-14-12/h7-9,11H,3-6H2,1-2H3
InChIKeyKOBJFTPSTXMGAB-UHFFFAOYSA-N
XLogP3.08
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(Cyclohexylmethyl)pyrazine
CID 16204532
2-Methyl-5-propylpyrazine
CID 122383
Pyrazine, (2-methylpropyl)-
CID 34591
Pentylpyrazine
CID 80551
2-Isobutyl-3,6-dimethyl-pyrazine
CID 520585
2,3-Dimethyl-5-(2-methylpropyl)pyrazine
CID 528108
2-Methyl-6-(3-methylbutyl)pyrazine
CID 572730
2-Isobutyl-3,5-dimethyl-pyrazine
CID 578817
2,5-Dimethyl-3-(3-methylbutyl)pyrazine
CID 519564
Pyrazine, 2-methyl-6-propyl-
CID 122380
5-Sec-butyl-2,3-dimethylpyrazine, 98%
CID 520567
2,3-Dimethyl-5-(2-methylbutyl)pyrazine
CID 528106

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(4-methylcyclohexyl)pyrazine?
The IUPAC name of 2-methyl-5-(4-methylcyclohexyl)pyrazine (CID 23588709) is 2-methyl-5-(4-methylcyclohexyl)pyrazine.
What is the SMILES notation for 2-methyl-5-(4-methylcyclohexyl)pyrazine?
The canonical SMILES for 2-methyl-5-(4-methylcyclohexyl)pyrazine is Cc1cnc(C2CCC(C)CC2)cn1.
What is the InChIKey of 2-methyl-5-(4-methylcyclohexyl)pyrazine?
The InChIKey is KOBJFTPSTXMGAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9-3-5-11(6-4-9)12-8-13-10(2)7-14-12/h7-9,11H,3-6H2,1-2H3.
What are the key properties of 2-methyl-5-(4-methylcyclohexyl)pyrazine?
2-methyl-5-(4-methylcyclohexyl)pyrazine has a molecular weight of 190.29 g/mol, XLogP of 3.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(4-methylcyclohexyl)pyrazine is sourced from PubChem (CID 23588709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).