6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine

C18H27N5O — CID 133484073

IUPAC6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine
SMILESCC(C)Cn1ccnc1CNc1cncc(OC2CCCCC2)n1
InChIInChI=1S/C18H27N5O/c1-14(2)13-23-9-8-20-17(23)11-21-16-10-19-12-18(22-16)24-15-6-4-3-5-7-15/h8-10,12,14-15H,3-7,11,13H2,1-2H3,(H,21,22)
InChIKeyXQQNHFONFFMBCK-UHFFFAOYSA-N
MW329.45 g/mol
LogP3.65
Rot. Bonds7

About 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine

6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine (PubChem CID 133484073) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine
PubChem CID133484073
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC Name6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine
SMILESCC(C)Cn1ccnc1CNc1cncc(OC2CCCCC2)n1
InChIInChI=1S/C18H27N5O/c1-14(2)13-23-9-8-20-17(23)11-21-16-10-19-12-18(22-16)24-15-6-4-3-5-7-15/h8-10,12,14-15H,3-7,11,13H2,1-2H3,(H,21,22)
InChIKeyXQQNHFONFFMBCK-UHFFFAOYSA-N
XLogP3.65
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine?
The IUPAC name of 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine (CID 133484073) is 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine.
What is the SMILES notation for 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine?
The canonical SMILES for 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine is CC(C)Cn1ccnc1CNc1cncc(OC2CCCCC2)n1.
What is the InChIKey of 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine?
The InChIKey is XQQNHFONFFMBCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O/c1-14(2)13-23-9-8-20-17(23)11-21-16-10-19-12-18(22-16)24-15-6-4-3-5-7-15/h8-10,12,14-15H,3-7,11,13H2,1-2H3,(H,21,22).
What are the key properties of 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine?
6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine has a molecular weight of 329.45 g/mol, XLogP of 3.65, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyloxy-N-[[1-(2-methylpropyl)imidazol-2-yl]methyl]pyrazin-2-amine is sourced from PubChem (CID 133484073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).