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

C11H12N2O — CID 71326268

IUPACN,N-dimethyl-4-(1,3-oxazol-5-yl)aniline
SMILESCN(C)c1ccc(-c2cnco2)cc1
InChIInChI=1S/C11H12N2O/c1-13(2)10-5-3-9(4-6-10)11-7-12-8-14-11/h3-8H,1-2H3
InChIKeyYBAWUGXUENRPFL-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.41
Rot. Bonds2

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

N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline (PubChem CID 71326268) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline.

Molecular Properties

Compound NameN,N-dimethyl-4-(1,3-oxazol-5-yl)aniline
PubChem CID71326268
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC NameN,N-dimethyl-4-(1,3-oxazol-5-yl)aniline
SMILESCN(C)c1ccc(-c2cnco2)cc1
InChIInChI=1S/C11H12N2O/c1-13(2)10-5-3-9(4-6-10)11-7-12-8-14-11/h3-8H,1-2H3
InChIKeyYBAWUGXUENRPFL-UHFFFAOYSA-N
XLogP2.41
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline?
The IUPAC name of N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline (CID 71326268) is N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline.
What is the SMILES notation for N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline?
The canonical SMILES for N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline is CN(C)c1ccc(-c2cnco2)cc1.
What is the InChIKey of N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline?
The InChIKey is YBAWUGXUENRPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-13(2)10-5-3-9(4-6-10)11-7-12-8-14-11/h3-8H,1-2H3.
What are the key properties of N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline?
N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline has a molecular weight of 188.23 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(1,3-oxazol-5-yl)aniline is sourced from PubChem (CID 71326268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).