5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine

C14H24N2O — CID 113490792

IUPAC5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine
SMILESCC(C)c1c(N)noc1C1CCCCCCC1
InChIInChI=1S/C14H24N2O/c1-10(2)12-13(17-16-14(12)15)11-8-6-4-3-5-7-9-11/h10-11H,3-9H2,1-2H3,(H2,15,16)
InChIKeyASWQPIXNPHKUPL-UHFFFAOYSA-N
MW236.36 g/mol
LogP4.21
Rot. Bonds2

About 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine

5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine (PubChem CID 113490792) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine
PubChem CID113490792
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine
SMILESCC(C)c1c(N)noc1C1CCCCCCC1
InChIInChI=1S/C14H24N2O/c1-10(2)12-13(17-16-14(12)15)11-8-6-4-3-5-7-9-11/h10-11H,3-9H2,1-2H3,(H2,15,16)
InChIKeyASWQPIXNPHKUPL-UHFFFAOYSA-N
XLogP4.21
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopentyl-4-iodo-1,2-oxazol-3-amine
CID 79557488
5-cyclopropyl-3,4-di(propan-2-yl)-1,2-oxazole
CID 146526741
5-cyclobutyl-4-methyl-1,2-oxazol-3-amine
CID 66198796
5-cyclopropyl-3-propan-2-yl-1,2-oxazol-4-amine
CID 82414163
5-cyclopropyl-4-propan-2-yl-1,2-oxazole-3-carboxylic acid
CID 105448821
4-(4-bromophenyl)-5-cyclohexyl-1,2-oxazol-3-amine
CID 66199516
5-cyclohexyl-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 66198368
(5-cycloheptyl-3-methyl-1,2-oxazol-4-yl)methanamine
CID 105462134
3-amino-5-cyclobutyl-1,2-oxazole-4-carboxylic acid
CID 105439905
5-cycloheptyl-4-(3-fluorophenyl)-1,2-oxazol-3-amine
CID 66199569
4-(2-chloro-6-fluorophenyl)-5-cycloheptyl-1,2-oxazol-3-amine
CID 66199498
1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-3-methylbutan-2-ol
CID 63345168

Frequently Asked Questions

What is the IUPAC name of 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine?
The IUPAC name of 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine (CID 113490792) is 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine.
What is the SMILES notation for 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine?
The canonical SMILES for 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine is CC(C)c1c(N)noc1C1CCCCCCC1.
What is the InChIKey of 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine?
The InChIKey is ASWQPIXNPHKUPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-10(2)12-13(17-16-14(12)15)11-8-6-4-3-5-7-9-11/h10-11H,3-9H2,1-2H3,(H2,15,16).
What are the key properties of 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine?
5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine has a molecular weight of 236.36 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclooctyl-4-propan-2-yl-1,2-oxazol-3-amine is sourced from PubChem (CID 113490792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).