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

C14H10Cl2N2O2 — CID 66200956

IUPAC4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine
SMILESCc1ccoc1-c1onc(N)c1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H10Cl2N2O2/c1-7-4-5-19-12(7)13-11(14(17)18-20-13)9-3-2-8(15)6-10(9)16/h2-6H,1H3,(H2,17,18)
InChIKeyWDPNRUCETFYIOU-UHFFFAOYSA-N
MW309.15 g/mol
LogP4.80
Rot. Bonds2

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

4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine (PubChem CID 66200956) has the molecular formula C14H10Cl2N2O2 and a molecular weight of 309.15 g/mol. Its IUPAC name is 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine
PubChem CID66200956
Molecular FormulaC14H10Cl2N2O2
Molecular Weight309.15 g/mol
Exact Mass308.01
IUPAC Name4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine
SMILESCc1ccoc1-c1onc(N)c1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H10Cl2N2O2/c1-7-4-5-19-12(7)13-11(14(17)18-20-13)9-3-2-8(15)6-10(9)16/h2-6H,1H3,(H2,17,18)
InChIKeyWDPNRUCETFYIOU-UHFFFAOYSA-N
XLogP4.80
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.15
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2,4-dichlorophenyl)-5-(3-methylphenyl)-1,2-oxazol-3-amine
CID 66200150
4-(2,4-dichlorophenyl)-5-pyridin-4-yl-1,2-oxazol-3-amine
CID 66199955
4-(3,4-dimethylphenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine
CID 66201310
5-(5-bromofuran-2-yl)-4-(2,4-dichlorophenyl)-1,2-oxazol-3-amine
CID 66200957
5-(2,4-dichlorophenyl)-4-iodo-1,2-oxazol-3-amine
CID 79555967
5-(2-chlorofuran-3-yl)-4-(5-chloro-2-methoxyphenyl)-1,2-oxazol-3-amine
CID 106690651
2,3-bis(2,4-dichlorophenyl)furan
CID 163320542
5-(5-chloro-2-methylphenyl)-4-methyl-1,2-oxazol-3-amine
CID 82890379
5-(4-chloro-2-fluorophenyl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66200871
5-cyclopentyl-4-(2,4-dichlorophenyl)-1,2-oxazol-3-amine
CID 66199951
5-(3-chloro-4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 82878281
4-(2,4-dichlorophenyl)-5-(2,2-dimethylcyclopentyl)-1,2-oxazol-3-amine
CID 107185949

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine?
The IUPAC name of 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine (CID 66200956) is 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine.
What is the SMILES notation for 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine?
The canonical SMILES for 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine is Cc1ccoc1-c1onc(N)c1-c1ccc(Cl)cc1Cl.
What is the InChIKey of 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine?
The InChIKey is WDPNRUCETFYIOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2O2/c1-7-4-5-19-12(7)13-11(14(17)18-20-13)9-3-2-8(15)6-10(9)16/h2-6H,1H3,(H2,17,18).
What are the key properties of 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine?
4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine has a molecular weight of 309.15 g/mol, XLogP of 4.80, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dichlorophenyl)-5-(3-methylfuran-2-yl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66200956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).