2-(diethylaminomethyl)-N-methylaniline

C12H20N2 — CID 23009383

IUPAC2-(diethylaminomethyl)-N-methylaniline
SMILESCCN(CC)Cc1ccccc1NC
InChIInChI=1S/C12H20N2/c1-4-14(5-2)10-11-8-6-7-9-12(11)13-3/h6-9,13H,4-5,10H2,1-3H3
InChIKeyIOACHHOZWQJDLL-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.57
Rot. Bonds5

About 2-(diethylaminomethyl)-N-methylaniline

2-(diethylaminomethyl)-N-methylaniline (PubChem CID 23009383) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 2-(diethylaminomethyl)-N-methylaniline.

Molecular Properties

Compound Name2-(diethylaminomethyl)-N-methylaniline
PubChem CID23009383
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name2-(diethylaminomethyl)-N-methylaniline
SMILESCCN(CC)Cc1ccccc1NC
InChIInChI=1S/C12H20N2/c1-4-14(5-2)10-11-8-6-7-9-12(11)13-3/h6-9,13H,4-5,10H2,1-3H3
InChIKeyIOACHHOZWQJDLL-UHFFFAOYSA-N
XLogP2.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(2,2-diethylhydrazinyl)phenyl]methyl]-N-ethylethanamine
CID 101120062
2-(diethylaminomethyl)-N-(2-methylpropyl)aniline
CID 43729309
1-(diethylaminomethyl)-2-(sulfamoylamino)benzene
CID 112573513
2-(diethylaminomethyl)-N-heptylaniline
CID 43729328
N'-tert-butyl-N-[2-(diethylaminomethyl)phenyl]ethane-1,2-diamine
CID 107445154
N-cyclohexyl-2-(diethylaminomethyl)aniline
CID 43729330
3-[[2-(diethylaminomethyl)anilino]methyl]phenol
CID 43729325
2-(diethylaminomethyl)-N-(3,5-dimethylcyclohexyl)aniline
CID 64751764
2-(diethylaminomethyl)-N-hexan-2-ylaniline
CID 43787790
N-(cyclopentylmethyl)-2-(diethylaminomethyl)aniline
CID 55034710
ethyl N-[2-(diethylaminomethyl)phenyl]carbamate
CID 61215408
2-(diethylaminomethyl)-N-(1-methylsulfonylpropan-2-yl)aniline
CID 64629331

Frequently Asked Questions

What is the IUPAC name of 2-(diethylaminomethyl)-N-methylaniline?
The IUPAC name of 2-(diethylaminomethyl)-N-methylaniline (CID 23009383) is 2-(diethylaminomethyl)-N-methylaniline.
What is the SMILES notation for 2-(diethylaminomethyl)-N-methylaniline?
The canonical SMILES for 2-(diethylaminomethyl)-N-methylaniline is CCN(CC)Cc1ccccc1NC.
What is the InChIKey of 2-(diethylaminomethyl)-N-methylaniline?
The InChIKey is IOACHHOZWQJDLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-14(5-2)10-11-8-6-7-9-12(11)13-3/h6-9,13H,4-5,10H2,1-3H3.
What are the key properties of 2-(diethylaminomethyl)-N-methylaniline?
2-(diethylaminomethyl)-N-methylaniline has a molecular weight of 192.31 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylaminomethyl)-N-methylaniline is sourced from PubChem (CID 23009383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).