N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline

C12H14N2O — CID 143735141

IUPACN-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline
SMILESCCN(C)c1ccc(-c2cnco2)cc1
InChIInChI=1S/C12H14N2O/c1-3-14(2)11-6-4-10(5-7-11)12-8-13-9-15-12/h4-9H,3H2,1-2H3
InChIKeyXAUONFXQXRKVRT-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.80
Rot. Bonds3

About N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline

N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline (PubChem CID 143735141) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline.

Molecular Properties

Compound NameN-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline
PubChem CID143735141
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline
SMILESCCN(C)c1ccc(-c2cnco2)cc1
InChIInChI=1S/C12H14N2O/c1-3-14(2)11-6-4-10(5-7-11)12-8-13-9-15-12/h4-9H,3H2,1-2H3
InChIKeyXAUONFXQXRKVRT-UHFFFAOYSA-N
XLogP2.80
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline?
The IUPAC name of N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline (CID 143735141) is N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline.
What is the SMILES notation for N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline?
The canonical SMILES for N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline is CCN(C)c1ccc(-c2cnco2)cc1.
What is the InChIKey of N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline?
The InChIKey is XAUONFXQXRKVRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-3-14(2)11-6-4-10(5-7-11)12-8-13-9-15-12/h4-9H,3H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline?
N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline has a molecular weight of 202.26 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-4-(1,3-oxazol-5-yl)aniline is sourced from PubChem (CID 143735141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).