5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine

C10H18N4O — CID 115753285

IUPAC5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine
SMILESCN(C)c1noc(C2CCC(N)CC2)n1
InChIInChI=1S/C10H18N4O/c1-14(2)10-12-9(15-13-10)7-3-5-8(11)6-4-7/h7-8H,3-6,11H2,1-2H3
InChIKeyUHUZHBAXFRCFIO-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.12
Rot. Bonds2

About 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine

5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine (PubChem CID 115753285) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine.

Molecular Properties

Compound Name5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine
PubChem CID115753285
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine
SMILESCN(C)c1noc(C2CCC(N)CC2)n1
InChIInChI=1S/C10H18N4O/c1-14(2)10-12-9(15-13-10)7-3-5-8(11)6-4-7/h7-8H,3-6,11H2,1-2H3
InChIKeyUHUZHBAXFRCFIO-UHFFFAOYSA-N
XLogP1.12
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine?
The IUPAC name of 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine (CID 115753285) is 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine.
What is the SMILES notation for 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine?
The canonical SMILES for 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine is CN(C)c1noc(C2CCC(N)CC2)n1.
What is the InChIKey of 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine?
The InChIKey is UHUZHBAXFRCFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-14(2)10-12-9(15-13-10)7-3-5-8(11)6-4-7/h7-8H,3-6,11H2,1-2H3.
What are the key properties of 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine?
5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine has a molecular weight of 210.28 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-aminocyclohexyl)-N,N-dimethyl-1,2,4-oxadiazol-3-amine is sourced from PubChem (CID 115753285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).