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

C15H19N3O — CID 119027837

IUPACN-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine
SMILESCc1cccc(-c2noc(NC3CCCCC3)n2)c1
InChIInChI=1S/C15H19N3O/c1-11-6-5-7-12(10-11)14-17-15(19-18-14)16-13-8-3-2-4-9-13/h5-7,10,13H,2-4,8-9H2,1H3,(H,16,17,18)
InChIKeyFPXRVRVVWGGDKH-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.79
Rot. Bonds3

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

N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine (PubChem CID 119027837) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound NameN-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine
PubChem CID119027837
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine
SMILESCc1cccc(-c2noc(NC3CCCCC3)n2)c1
InChIInChI=1S/C15H19N3O/c1-11-6-5-7-12(10-11)14-17-15(19-18-14)16-13-8-3-2-4-9-13/h5-7,10,13H,2-4,8-9H2,1H3,(H,16,17,18)
InChIKeyFPXRVRVVWGGDKH-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-cycloheptyl-3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-amine
CID 46342228
N-cycloheptyl-3-(3-methylphenyl)-1,2,4-oxadiazole-5-carboxamide
CID 6471248
N-cyclohexyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)aniline
CID 70002094
N-cyclohexyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine
CID 119027868
3-(3-methylphenyl)-5-piperidin-2-yl-1,2,4-oxadiazole
CID 43109257
3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine
CID 62471073
2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]cycloheptan-1-one
CID 63346364
N-cycloheptyl-3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-amine
CID 46342176
(3R)-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-amine
CID 95228881
(2S)-N-cyclopentyl-2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidine-1-carboxamide
CID 95116675
N-cyclopropyl-3-(2-methylphenyl)-1,2,4-oxadiazol-5-amine
CID 62595048
3-(3-methylphenyl)-5-phenyl-1,2,4-oxadiazole
CID 2239223

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine?
The IUPAC name of N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine (CID 119027837) is N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine?
The canonical SMILES for N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine is Cc1cccc(-c2noc(NC3CCCCC3)n2)c1.
What is the InChIKey of N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine?
The InChIKey is FPXRVRVVWGGDKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-11-6-5-7-12(10-11)14-17-15(19-18-14)16-13-8-3-2-4-9-13/h5-7,10,13H,2-4,8-9H2,1H3,(H,16,17,18).
What are the key properties of N-cyclohexyl-3-(3-methylphenyl)-1,2,4-oxadiazol-5-amine?
N-cyclohexyl-3-(3-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-(3-methylphenyl)-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 119027837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).