N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine

C15H19N3O — CID 119027868

IUPACN-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine
SMILESCc1ccccc1-c1noc(NC2CCCCC2)n1
InChIInChI=1S/C15H19N3O/c1-11-7-5-6-10-13(11)14-17-15(19-18-14)16-12-8-3-2-4-9-12/h5-7,10,12H,2-4,8-9H2,1H3,(H,16,17,18)
InChIKeyGMNIHNQHBAZMLY-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.79
Rot. Bonds3

About N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine

N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine (PubChem CID 119027868) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound NameN-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine
PubChem CID119027868
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine
SMILESCc1ccccc1-c1noc(NC2CCCCC2)n1
InChIInChI=1S/C15H19N3O/c1-11-7-5-6-10-13(11)14-17-15(19-18-14)16-12-8-3-2-4-9-12/h5-7,10,12H,2-4,8-9H2,1H3,(H,16,17,18)
InChIKeyGMNIHNQHBAZMLY-UHFFFAOYSA-N
XLogP3.79
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine
CID 62595048
N-cycloheptyl-3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-amine
CID 46342176
N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine
CID 119027837
N-cyclopropyl-3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-amine
CID 55096100
3-(2-methylphenyl)-5-piperidin-2-yl-1,2,4-oxadiazole
CID 43102485
N-cycloheptyl-3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-amine
CID 46342228
5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-(oxan-4-yl)pyridin-2-amine
CID 45216823
4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]cyclohexan-1-amine
CID 60811920
5-(2,3-dihydro-1H-indol-2-yl)-3-(2-methylphenyl)-1,2,4-oxadiazole
CID 43095791
N-methyl-1-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]pyrrolidin-3-amine
CID 81492893
3-(2-bromo-3,4-difluorophenyl)-N-cyclopropyl-1,2,4-oxadiazol-5-amine
CID 107539889
3-(2-methylphenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]-1,2,4-oxadiazol-5-amine
CID 91966320

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine?
The IUPAC name of N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine (CID 119027868) is N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine?
The canonical SMILES for N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine is Cc1ccccc1-c1noc(NC2CCCCC2)n1.
What is the InChIKey of N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine?
The InChIKey is GMNIHNQHBAZMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-11-7-5-6-10-13(11)14-17-15(19-18-14)16-12-8-3-2-4-9-12/h5-7,10,12H,2-4,8-9H2,1H3,(H,16,17,18).
What are the key properties of N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine?
N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine has a molecular weight of 257.34 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 119027868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).