N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline

C13H22N2 — CID 43281572

IUPACN-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
SMILESCCN(C)c1ccccc1CNC(C)C
InChIInChI=1S/C13H22N2/c1-5-15(4)13-9-7-6-8-12(13)10-14-11(2)3/h6-9,11,14H,5,10H2,1-4H3
InChIKeyJRWIZUQOZRHZEJ-UHFFFAOYSA-N
MW206.33 g/mol
LogP2.64
Rot. Bonds5

About N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline

N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline (PubChem CID 43281572) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
PubChem CID43281572
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC NameN-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
SMILESCCN(C)c1ccccc1CNC(C)C
InChIInChI=1S/C13H22N2/c1-5-15(4)13-9-7-6-8-12(13)10-14-11(2)3/h6-9,11,14H,5,10H2,1-4H3
InChIKeyJRWIZUQOZRHZEJ-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
CID 43280656
N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81248510
5-bromo-N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
CID 43281562
N-[(4-bromophenyl)methyl]-N-methyl-2-[(propan-2-ylamino)methyl]aniline
CID 63553389
N-ethyl-2-[(propan-2-ylamino)methyl]-N-(2,2,2-trifluoroethyl)aniline
CID 55009119
1-methoxy-3-[N-methyl-2-[(propan-2-ylamino)methyl]anilino]propan-2-ol
CID 54994011
N-methyl-2-[(propan-2-ylamino)methyl]-N-(pyridin-3-ylmethyl)aniline
CID 43563622
N-ethyl-N-methyl-3-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62280566
N-methyl-N-[(1-methylimidazol-2-yl)methyl]-2-[(propan-2-ylamino)methyl]aniline
CID 63025572
N-methyl-N-[2-[(propan-2-ylamino)methyl]phenyl]thiolan-3-amine
CID 43296917
2-(ethylaminomethyl)-N-methyl-N-(2-methylpropyl)aniline
CID 43281923
N-methyl-N-[[2-[(propan-2-ylamino)methyl]phenyl]methyl]propan-1-amine
CID 62417579

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline?
The IUPAC name of N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline (CID 43281572) is N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline.
What is the SMILES notation for N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline?
The canonical SMILES for N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline is CCN(C)c1ccccc1CNC(C)C.
What is the InChIKey of N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline?
The InChIKey is JRWIZUQOZRHZEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-5-15(4)13-9-7-6-8-12(13)10-14-11(2)3/h6-9,11,14H,5,10H2,1-4H3.
What are the key properties of N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline?
N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline has a molecular weight of 206.33 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline is sourced from PubChem (CID 43281572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).