N,N-diethyl-2-(methylaminomethyl)aniline

C12H20N2 — CID 43243693

IUPACN,N-diethyl-2-(methylaminomethyl)aniline
SMILESCCN(CC)c1ccccc1CNC
InChIInChI=1S/C12H20N2/c1-4-14(5-2)12-9-7-6-8-11(12)10-13-3/h6-9,13H,4-5,10H2,1-3H3
InChIKeyQQFGPYHCCGBCAC-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.25
Rot. Bonds5

About N,N-diethyl-2-(methylaminomethyl)aniline

N,N-diethyl-2-(methylaminomethyl)aniline (PubChem CID 43243693) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is N,N-diethyl-2-(methylaminomethyl)aniline.

Molecular Properties

Compound NameN,N-diethyl-2-(methylaminomethyl)aniline
PubChem CID43243693
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC NameN,N-diethyl-2-(methylaminomethyl)aniline
SMILESCCN(CC)c1ccccc1CNC
InChIInChI=1S/C12H20N2/c1-4-14(5-2)12-9-7-6-8-11(12)10-13-3/h6-9,13H,4-5,10H2,1-3H3
InChIKeyQQFGPYHCCGBCAC-UHFFFAOYSA-N
XLogP2.25
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 ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(methylaminomethyl)aniline?
The IUPAC name of N,N-diethyl-2-(methylaminomethyl)aniline (CID 43243693) is N,N-diethyl-2-(methylaminomethyl)aniline.
What is the SMILES notation for N,N-diethyl-2-(methylaminomethyl)aniline?
The canonical SMILES for N,N-diethyl-2-(methylaminomethyl)aniline is CCN(CC)c1ccccc1CNC.
What is the InChIKey of N,N-diethyl-2-(methylaminomethyl)aniline?
The InChIKey is QQFGPYHCCGBCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-4-14(5-2)12-9-7-6-8-11(12)10-13-3/h6-9,13H,4-5,10H2,1-3H3.
What are the key properties of N,N-diethyl-2-(methylaminomethyl)aniline?
N,N-diethyl-2-(methylaminomethyl)aniline has a molecular weight of 192.31 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(methylaminomethyl)aniline is sourced from PubChem (CID 43243693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).