N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine

C11H19N3O — CID 103698868

IUPACN-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine
SMILESCc1nc(CCNC2CCCCC2)no1
InChIInChI=1S/C11H19N3O/c1-9-13-11(14-15-9)7-8-12-10-5-3-2-4-6-10/h10,12H,2-8H2,1H3
InChIKeyBRBBWLXLTLIZJG-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.84
Rot. Bonds4

About N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine

N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine (PubChem CID 103698868) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine.

Molecular Properties

Compound NameN-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine
PubChem CID103698868
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine
SMILESCc1nc(CCNC2CCCCC2)no1
InChIInChI=1S/C11H19N3O/c1-9-13-11(14-15-9)7-8-12-10-5-3-2-4-6-10/h10,12H,2-8H2,1H3
InChIKeyBRBBWLXLTLIZJG-UHFFFAOYSA-N
XLogP1.84
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
CID 113243071
4-tert-butyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
CID 103698883
3-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclopentan-1-amine
CID 103698869
2-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
CID 103931523
2,6-dimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
CID 103931580
2-methyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclopentan-1-amine
CID 103748222
2-(aminomethyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
CID 106413713
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-propan-2-yloxan-4-amine
CID 103931537
2-(aminomethyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclopentan-1-amine
CID 106413869
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 106413636
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-methylsulfonylcyclopentan-1-amine
CID 103931536
1-(cyclopropylamino)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propane-2-sulfonamide
CID 106423680

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine?
The IUPAC name of N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine (CID 103698868) is N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine.
What is the SMILES notation for N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine?
The canonical SMILES for N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine is Cc1nc(CCNC2CCCCC2)no1.
What is the InChIKey of N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine?
The InChIKey is BRBBWLXLTLIZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9-13-11(14-15-9)7-8-12-10-5-3-2-4-6-10/h10,12H,2-8H2,1H3.
What are the key properties of N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine?
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine has a molecular weight of 209.29 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cyclohexanamine is sourced from PubChem (CID 103698868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).