4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine

C16H19ClN2O — CID 107185895

IUPAC4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine
SMILESCC1(C)CCCC1c1onc(N)c1-c1ccccc1Cl
InChIInChI=1S/C16H19ClN2O/c1-16(2)9-5-7-11(16)14-13(15(18)19-20-14)10-6-3-4-8-12(10)17/h3-4,6,8,11H,5,7,9H2,1-2H3,(H2,18,19)
InChIKeyOYGZEQBTMOPXKL-UHFFFAOYSA-N
MW290.79 g/mol
LogP4.87
Rot. Bonds2

About 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine

4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine (PubChem CID 107185895) has the molecular formula C16H19ClN2O and a molecular weight of 290.79 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine
PubChem CID107185895
Molecular FormulaC16H19ClN2O
Molecular Weight290.79 g/mol
Exact Mass290.12
IUPAC Name4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine
SMILESCC1(C)CCCC1c1onc(N)c1-c1ccccc1Cl
InChIInChI=1S/C16H19ClN2O/c1-16(2)9-5-7-11(16)14-13(15(18)19-20-14)10-6-3-4-8-12(10)17/h3-4,6,8,11H,5,7,9H2,1-2H3,(H2,18,19)
InChIKeyOYGZEQBTMOPXKL-UHFFFAOYSA-N
XLogP4.87
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.79
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,4-dichlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine
CID 107185949
5-(2,2-dimethylcyclopentyl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
CID 107186032
4-(2,4-difluorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine
CID 107186064
4-(3-chloro-2-fluorophenyl)-5-(2,2-dimethylcyclopropyl)-1,2-oxazol-3-amine
CID 107003659
4-(2,4-dichlorophenyl)-3-(2,2-dimethylcyclopentyl)-1,2-oxazol-5-amine
CID 107179712
4-(2-chlorophenyl)-5-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66204374
5-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-3-amine
CID 66199951
4-(2-chlorophenyl)-3-(1-methylcyclohexyl)-1,2-oxazol-5-amine
CID 106827684
4-(2-chlorophenyl)-5-(2,6-dichlorophenyl)-1,2-oxazol-3-amine
CID 66205609
5-cyclopropyl-4-(2-fluorophenyl)-1,2-oxazol-3-amine
CID 66199156
4-(2-chlorophenyl)-5-(2-fluorophenyl)-1,2-oxazol-3-amine
CID 66206213
5-(2,2-dimethylcyclohexyl)-4-ethyl-1,2-oxazol-3-amine
CID 107186010

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine?
The IUPAC name of 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine (CID 107185895) is 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine?
The canonical SMILES for 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine is CC1(C)CCCC1c1onc(N)c1-c1ccccc1Cl.
What is the InChIKey of 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine?
The InChIKey is OYGZEQBTMOPXKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O/c1-16(2)9-5-7-11(16)14-13(15(18)19-20-14)10-6-3-4-8-12(10)17/h3-4,6,8,11H,5,7,9H2,1-2H3,(H2,18,19).
What are the key properties of 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine?
4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine has a molecular weight of 290.79 g/mol, XLogP of 4.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 107185895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).