3-(2,6-diethylphenyl)azetidin-3-amine

C13H20N2 — CID 166608620

IUPAC3-(2,6-diethylphenyl)azetidin-3-amine
SMILESCCc1cccc(CC)c1C1(N)CNC1
InChIInChI=1S/C13H20N2/c1-3-10-6-5-7-11(4-2)12(10)13(14)8-15-9-13/h5-7,15H,3-4,8-9,14H2,1-2H3
InChIKeyRAWIPOVGJWJDPM-UHFFFAOYSA-N
MW204.32 g/mol
LogP1.57
Rot. Bonds3

About 3-(2,6-diethylphenyl)azetidin-3-amine

3-(2,6-diethylphenyl)azetidin-3-amine (PubChem CID 166608620) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 3-(2,6-diethylphenyl)azetidin-3-amine.

Molecular Properties

Compound Name3-(2,6-diethylphenyl)azetidin-3-amine
PubChem CID166608620
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name3-(2,6-diethylphenyl)azetidin-3-amine
SMILESCCc1cccc(CC)c1C1(N)CNC1
InChIInChI=1S/C13H20N2/c1-3-10-6-5-7-11(4-2)12(10)13(14)8-15-9-13/h5-7,15H,3-4,8-9,14H2,1-2H3
InChIKeyRAWIPOVGJWJDPM-UHFFFAOYSA-N
XLogP1.57
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(2,6-diethylphenyl)cyclohexyl]methanamine
CID 117366409
2,6-diethylaniline;propane
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2,6-diethylaniline;iron(2+)
CID 175873065
3-[(2,3-dichlorophenyl)methyl]-3-ethylazetidine
CID 107310931
4-ethylspiro[1,2-dihydroindene-3,1'-cyclopropane]
CID 169181422
4,7-diethyl-3,3-dimethyl-2H-inden-1-one
CID 79837642
1,2-diethylbenzene;hydrobromide
CID 174973685
1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide
CID 65463970
1,3-diethyl-2-iodobenzene
CID 18690512
2-ethyl-6-(piperazin-1-ylmethyl)aniline
CID 82509243
3-ethyl-3-[(2-fluoro-3-methoxyphenyl)methyl]azetidine
CID 104795594
3-ethyl-2-methylaniline
CID 19879636

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-diethylphenyl)azetidin-3-amine?
The IUPAC name of 3-(2,6-diethylphenyl)azetidin-3-amine (CID 166608620) is 3-(2,6-diethylphenyl)azetidin-3-amine.
What is the SMILES notation for 3-(2,6-diethylphenyl)azetidin-3-amine?
The canonical SMILES for 3-(2,6-diethylphenyl)azetidin-3-amine is CCc1cccc(CC)c1C1(N)CNC1.
What is the InChIKey of 3-(2,6-diethylphenyl)azetidin-3-amine?
The InChIKey is RAWIPOVGJWJDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-3-10-6-5-7-11(4-2)12(10)13(14)8-15-9-13/h5-7,15H,3-4,8-9,14H2,1-2H3.
What are the key properties of 3-(2,6-diethylphenyl)azetidin-3-amine?
3-(2,6-diethylphenyl)azetidin-3-amine has a molecular weight of 204.32 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-diethylphenyl)azetidin-3-amine is sourced from PubChem (CID 166608620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).