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

C9H7ClN2O — CID 62065008

IUPAC4-(2-chlorophenyl)-1,3-oxazol-2-amine
SMILESNc1nc(-c2ccccc2Cl)co1
InChIInChI=1S/C9H7ClN2O/c10-7-4-2-1-3-6(7)8-5-13-9(11)12-8/h1-5H,(H2,11,12)
InChIKeyLCVLNQQCYQAJTH-UHFFFAOYSA-N
MW194.62 g/mol
LogP2.58
Rot. Bonds1

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

4-(2-chlorophenyl)-1,3-oxazol-2-amine (PubChem CID 62065008) has the molecular formula C9H7ClN2O and a molecular weight of 194.62 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-1,3-oxazol-2-amine.

Molecular Properties

Compound Name4-(2-chlorophenyl)-1,3-oxazol-2-amine
PubChem CID62065008
Molecular FormulaC9H7ClN2O
Molecular Weight194.62 g/mol
Exact Mass194.02
IUPAC Name4-(2-chlorophenyl)-1,3-oxazol-2-amine
SMILESNc1nc(-c2ccccc2Cl)co1
InChIInChI=1S/C9H7ClN2O/c10-7-4-2-1-3-6(7)8-5-13-9(11)12-8/h1-5H,(H2,11,12)
InChIKeyLCVLNQQCYQAJTH-UHFFFAOYSA-N
XLogP2.58
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.62
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-Chlorophenyl)-1,3-oxazol-2-amine
CID 12425131
Acetamide, N-(4-phenyl-2-oxazolyl)-
CID 37199
4-Phenyl-1,3-oxazol-2-amine
CID 520605
4-(4-Bromophenyl)-1,3-oxazol-2-amine
CID 12753432
N-Butyl-N-[4-(4-chlorophenyl)-1,3-oxazol-2-YL]-2-methylpropanamide
CID 12556920
2-(4-Phenyl-1,3-oxazol-2-yl)guanidine
CID 44367488
4-(2,6-Difluorophenyl)-1,3-oxazol-2-amine
CID 62066646
4-(2-Fluorophenyl)-1,3-oxazol-2-amine
CID 62066648
3-Chloro-2-methyl-N-(4-phenyl-oxazol-2-yl)-benzenesulfonamide
CID 44402534
(E)-N-[4-(4-chlorophenyl)-1,3-oxazol-2-yl]-3-phenylprop-2-enamide
CID 56930627
2-Amino-4-(naphth-1-yl)oxazole
CID 10307957
4-[4-(Phenylmethyl)phenyl]-1,3-oxazol-2-amine
CID 163348709

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-1,3-oxazol-2-amine?
The IUPAC name of 4-(2-chlorophenyl)-1,3-oxazol-2-amine (CID 62065008) is 4-(2-chlorophenyl)-1,3-oxazol-2-amine.
What is the SMILES notation for 4-(2-chlorophenyl)-1,3-oxazol-2-amine?
The canonical SMILES for 4-(2-chlorophenyl)-1,3-oxazol-2-amine is Nc1nc(-c2ccccc2Cl)co1.
What is the InChIKey of 4-(2-chlorophenyl)-1,3-oxazol-2-amine?
The InChIKey is LCVLNQQCYQAJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O/c10-7-4-2-1-3-6(7)8-5-13-9(11)12-8/h1-5H,(H2,11,12).
What are the key properties of 4-(2-chlorophenyl)-1,3-oxazol-2-amine?
4-(2-chlorophenyl)-1,3-oxazol-2-amine has a molecular weight of 194.62 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-1,3-oxazol-2-amine is sourced from PubChem (CID 62065008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).