3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine

C14H14Cl2N2O — CID 43335969

IUPAC3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine
SMILESNc1onc(C2CCCC2)c1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H14Cl2N2O/c15-9-5-6-10(11(16)7-9)12-13(18-19-14(12)17)8-3-1-2-4-8/h5-8H,1-4,17H2
InChIKeyJQBBARVQJYNYMV-UHFFFAOYSA-N
MW297.19 g/mol
LogP4.89
Rot. Bonds2

About 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine

3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine (PubChem CID 43335969) has the molecular formula C14H14Cl2N2O and a molecular weight of 297.19 g/mol. Its IUPAC name is 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine
PubChem CID43335969
Molecular FormulaC14H14Cl2N2O
Molecular Weight297.19 g/mol
Exact Mass296.05
IUPAC Name3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine
SMILESNc1onc(C2CCCC2)c1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H14Cl2N2O/c15-9-5-6-10(11(16)7-9)12-13(18-19-14(12)17)8-3-1-2-4-8/h5-8H,1-4,17H2
InChIKeyJQBBARVQJYNYMV-UHFFFAOYSA-N
XLogP4.89
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.19
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-chloro-2-methoxyphenyl)-3-cyclopentyl-1,2-oxazol-5-amine
CID 43336109
4-(2,4-dichlorophenyl)-3-(2,2-dimethylcyclopentyl)-1,2-oxazol-5-amine
CID 107179712
5-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-3-amine
CID 66199951
5-(cyclopentylmethyl)-4-(2,4-dichlorophenyl)-1,2-oxazol-3-amine
CID 66198154
3-cyclohexyl-4-phenyl-1,2-oxazol-5-amine
CID 43158023
5-(cyclohexylmethyl)-4-(2,4-dichlorophenyl)-1,2-oxazol-3-amine
CID 66198156
5-(2-cyclopentylethyl)-4-(2,4-dichlorophenyl)-1,2-oxazol-3-amine
CID 66199751
3-cycloheptyl-4-(2-methoxyphenyl)-1,2-oxazol-5-amine
CID 62588706
4-(3-chlorophenyl)-3-(oxan-3-yl)-1,2-oxazol-5-amine
CID 55150697
4-(3,4-dichlorophenyl)-3-(oxan-3-yl)-1,2-oxazol-5-amine
CID 63013669
3-cyclopropyl-4-(2,5-dimethylphenyl)-1,2-oxazol-5-amine
CID 82081360
4-(2,4-dichlorophenyl)-3-heptan-4-yl-1,2-oxazol-5-amine
CID 82989478

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine (CID 43335969) is 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine is Nc1onc(C2CCCC2)c1-c1ccc(Cl)cc1Cl.
What is the InChIKey of 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine?
The InChIKey is JQBBARVQJYNYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O/c15-9-5-6-10(11(16)7-9)12-13(18-19-14(12)17)8-3-1-2-4-8/h5-8H,1-4,17H2.
What are the key properties of 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine?
3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine has a molecular weight of 297.19 g/mol, XLogP of 4.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 43335969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).