N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine

C14H24N2 — CID 28585667

IUPACN-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine
SMILESCCN(CC)CCNc1cccc(C)c1C
InChIInChI=1S/C14H24N2/c1-5-16(6-2)11-10-15-14-9-7-8-12(3)13(14)4/h7-9,15H,5-6,10-11H2,1-4H3
InChIKeyVGYTWFHHFGGHPC-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.06
Rot. Bonds6

About N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine

N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine (PubChem CID 28585667) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine
PubChem CID28585667
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC NameN-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine
SMILESCCN(CC)CCNc1cccc(C)c1C
InChIInChI=1S/C14H24N2/c1-5-16(6-2)11-10-15-14-9-7-8-12(3)13(14)4/h7-9,15H,5-6,10-11H2,1-4H3
InChIKeyVGYTWFHHFGGHPC-UHFFFAOYSA-N
XLogP3.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine?
The IUPAC name of N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine (CID 28585667) is N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine.
What is the SMILES notation for N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine?
The canonical SMILES for N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine is CCN(CC)CCNc1cccc(C)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine?
The InChIKey is VGYTWFHHFGGHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-5-16(6-2)11-10-15-14-9-7-8-12(3)13(14)4/h7-9,15H,5-6,10-11H2,1-4H3.
What are the key properties of N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine?
N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-N',N'-diethylethane-1,2-diamine is sourced from PubChem (CID 28585667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).