4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline

C11H15NO2 — CID 708555

IUPAC4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline
SMILESCN(C)c1ccc(C2OCCO2)cc1
InChIInChI=1S/C11H15NO2/c1-12(2)10-5-3-9(4-6-10)11-13-7-8-14-11/h3-6,11H,7-8H2,1-2H3
InChIKeyHPNDRFVXKKTZTB-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.80
Rot. Bonds2

About 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline

4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline (PubChem CID 708555) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline.

Molecular Properties

Compound Name4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline
PubChem CID708555
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline
SMILESCN(C)c1ccc(C2OCCO2)cc1
InChIInChI=1S/C11H15NO2/c1-12(2)10-5-3-9(4-6-10)11-13-7-8-14-11/h3-6,11H,7-8H2,1-2H3
InChIKeyHPNDRFVXKKTZTB-UHFFFAOYSA-N
XLogP1.80
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

transpDMA
CID 91885418
1,4-Bis[4-(1,3-dioxolan-2-yl)phenyl]piperazine
CID 3006254
p-(Dimethylamino)benzyl alcohol acetate
CID 12219162
m-Dioxane, 2-(p-bis(2-(chloroethyl)amino)phenyl)-
CID 25358
N,N-Dimethyl-4-(3-methyl-1,3-oxazolidin-2-yl)aniline
CID 3068529
Oxazolidine, 2-(p-(diethylamino)phenyl)-3-methyl-
CID 3068530
4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline
CID 4206872
4-(1,3-dioxolan-2-yl)-N-hexadecylaniline
CID 13019277
4-Dimethylaminobenzaldehyde diethyl acetal
CID 499383
4-(dimethoxymethyl)-N,N-dimethylaniline
CID 11819993
4-(methoxymethyl)-N,N-dimethylaniline
CID 11829789
4-(1-methoxyethyl)-N,N-dimethylaniline
CID 14923984

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline?
The IUPAC name of 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline (CID 708555) is 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline.
What is the SMILES notation for 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline?
The canonical SMILES for 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline is CN(C)c1ccc(C2OCCO2)cc1.
What is the InChIKey of 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline?
The InChIKey is HPNDRFVXKKTZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-12(2)10-5-3-9(4-6-10)11-13-7-8-14-11/h3-6,11H,7-8H2,1-2H3.
What are the key properties of 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline?
4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline has a molecular weight of 193.25 g/mol, XLogP of 1.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-dioxolan-2-yl)-N,N-dimethylaniline is sourced from PubChem (CID 708555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).