2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine

C10H19N3O — CID 143346929

IUPAC2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine
SMILESCN.Cc1nnc(C2CCCCC2)o1
InChIInChI=1S/C9H14N2O.CH5N/c1-7-10-11-9(12-7)8-5-3-2-4-6-8;1-2/h8H,2-6H2,1H3;2H2,1H3
InChIKeyLHUZEIGEVVQNOI-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.00
Rot. Bonds1

About 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine

2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine (PubChem CID 143346929) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine.

Molecular Properties

Compound Name2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine
PubChem CID143346929
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine
SMILESCN.Cc1nnc(C2CCCCC2)o1
InChIInChI=1S/C9H14N2O.CH5N/c1-7-10-11-9(12-7)8-5-3-2-4-6-8;1-2/h8H,2-6H2,1H3;2H2,1H3
InChIKeyLHUZEIGEVVQNOI-UHFFFAOYSA-N
XLogP2.00
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine?
The IUPAC name of 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine (CID 143346929) is 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine.
What is the SMILES notation for 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine?
The canonical SMILES for 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine is CN.Cc1nnc(C2CCCCC2)o1.
What is the InChIKey of 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine?
The InChIKey is LHUZEIGEVVQNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O.CH5N/c1-7-10-11-9(12-7)8-5-3-2-4-6-8;1-2/h8H,2-6H2,1H3;2H2,1H3.
What are the key properties of 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine?
2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine has a molecular weight of 197.28 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine is sourced from PubChem (CID 143346929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).