4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine

C14H18N2O3 — CID 117410390

IUPAC4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine
SMILESCOc1ccc(-c2cnoc2N)c(OC)c1C(C)C
InChIInChI=1S/C14H18N2O3/c1-8(2)12-11(17-3)6-5-9(13(12)18-4)10-7-16-19-14(10)15/h5-8H,15H2,1-4H3
InChIKeyWQGGURJURHMQMV-UHFFFAOYSA-N
MW262.31 g/mol
LogP3.06
Rot. Bonds4

About 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine

4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine (PubChem CID 117410390) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine
PubChem CID117410390
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine
SMILESCOc1ccc(-c2cnoc2N)c(OC)c1C(C)C
InChIInChI=1S/C14H18N2O3/c1-8(2)12-11(17-3)6-5-9(13(12)18-4)10-7-16-19-14(10)15/h5-8H,15H2,1-4H3
InChIKeyWQGGURJURHMQMV-UHFFFAOYSA-N
XLogP3.06
TPSA70.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(5-bromo-3-methoxy-2-propan-2-ylphenyl)-1,2-oxazol-5-amine
CID 117496003
4-(4-fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 117297113
4-(3-methoxy-2-methylphenyl)-1,2-oxazol-5-amine
CID 117292477
4-(5-tert-butyl-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 82365983
4-[2-(difluoromethyl)-4,5-dimethoxyphenyl]-1,2-oxazol-5-amine
CID 117428577
4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine
CID 117405284
4-(2-methoxynaphthalen-1-yl)-1,2-oxazol-5-amine
CID 117353085
4-(2-chloro-4,5-dimethoxyphenyl)-1,2-oxazol-5-amine
CID 117389663
4-(2-bromo-3-methoxy-6-methylphenyl)-1,2-oxazol-5-amine
CID 117454876
2-(5-amino-1,2-oxazol-4-yl)-5-bromo-4-methoxyphenol
CID 117458746
4-[5-(2-fluoropropan-2-yl)-2,3-dimethoxyphenyl]-1,2-oxazol-5-amine
CID 117449841
4-[2,4-bis(methylsulfanyl)phenyl]-1,2-oxazol-5-amine
CID 117384436

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine (CID 117410390) is 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine is COc1ccc(-c2cnoc2N)c(OC)c1C(C)C.
What is the InChIKey of 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine?
The InChIKey is WQGGURJURHMQMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-8(2)12-11(17-3)6-5-9(13(12)18-4)10-7-16-19-14(10)15/h5-8H,15H2,1-4H3.
What are the key properties of 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine?
4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine has a molecular weight of 262.31 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethoxy-3-propan-2-ylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 117410390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).