1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine

C14H21N5O — CID 106567783

IUPAC1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine
SMILESCc1cn(C2CCCCC2)c(NCc2nc(C)no2)n1
InChIInChI=1S/C14H21N5O/c1-10-9-19(12-6-4-3-5-7-12)14(16-10)15-8-13-17-11(2)18-20-13/h9,12H,3-8H2,1-2H3,(H,15,16)
InChIKeyJUDMDRPSGYJJPW-UHFFFAOYSA-N
MW275.36 g/mol
LogP3.00
Rot. Bonds4

About 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine

1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine (PubChem CID 106567783) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine
PubChem CID106567783
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine
SMILESCc1cn(C2CCCCC2)c(NCc2nc(C)no2)n1
InChIInChI=1S/C14H21N5O/c1-10-9-19(12-6-4-3-5-7-12)14(16-10)15-8-13-17-11(2)18-20-13/h9,12H,3-8H2,1-2H3,(H,15,16)
InChIKeyJUDMDRPSGYJJPW-UHFFFAOYSA-N
XLogP3.00
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine?
The IUPAC name of 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine (CID 106567783) is 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine?
The canonical SMILES for 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine is Cc1cn(C2CCCCC2)c(NCc2nc(C)no2)n1.
What is the InChIKey of 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine?
The InChIKey is JUDMDRPSGYJJPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-10-9-19(12-6-4-3-5-7-12)14(16-10)15-8-13-17-11(2)18-20-13/h9,12H,3-8H2,1-2H3,(H,15,16).
What are the key properties of 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine?
1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine has a molecular weight of 275.36 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 106567783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).