N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine

C14H24N2 — CID 115195540

IUPACN'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine
SMILESCc1ccc(CCN(C)CCN)c(C)c1C
InChIInChI=1S/C14H24N2/c1-11-5-6-14(13(3)12(11)2)7-9-16(4)10-8-15/h5-6H,7-10,15H2,1-4H3
InChIKeyQFTKEELULHMZLE-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.04
Rot. Bonds5

About N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine

N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine (PubChem CID 115195540) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine
PubChem CID115195540
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC NameN'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine
SMILESCc1ccc(CCN(C)CCN)c(C)c1C
InChIInChI=1S/C14H24N2/c1-11-5-6-14(13(3)12(11)2)7-9-16(4)10-8-15/h5-6H,7-10,15H2,1-4H3
InChIKeyQFTKEELULHMZLE-UHFFFAOYSA-N
XLogP2.04
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[methyl-[2-(2,3,4-trimethylphenyl)ethyl]amino]butan-1-ol
CID 115217930
1-methyl-1-[2-(2,3,4-trimethylphenyl)ethyl]urea
CID 115168718
N-methyl-2-oxo-N-[2-(2,3,4-trimethylphenyl)ethyl]propanamide
CID 115176081
N-methyl-3-(2,3,4-trimethylphenyl)propanehydrazide
CID 116845038
N-methyl-2-(methylamino)-N-[2-(2,3,4-trimethylphenyl)ethyl]acetamide
CID 115152139
3-N-methyl-3-N-[(2,3,4-trimethylphenyl)methyl]butane-1,3-diamine
CID 117040414
[methyl-[(2,3,4-trimethylphenyl)methyl]amino]methanol
CID 115229232
3-[methyl-[(2,3,4-trimethylphenyl)methyl]amino]propanoic acid
CID 115218318
N'-[(2,3,4-trimethylphenyl)methyl]methanediamine
CID 115225803
[2-(4-methoxy-2,3-dimethylphenyl)ethyl-methylamino]methanol
CID 115229495
4-[2-(4-methoxy-2,3-dimethylphenyl)ethyl-methylamino]butan-2-one
CID 115236061
3-methyl-3-(2,3,4-trimethylphenyl)butan-1-amine
CID 116962225

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine?
The IUPAC name of N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine (CID 115195540) is N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine is Cc1ccc(CCN(C)CCN)c(C)c1C.
What is the InChIKey of N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine?
The InChIKey is QFTKEELULHMZLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-11-5-6-14(13(3)12(11)2)7-9-16(4)10-8-15/h5-6H,7-10,15H2,1-4H3.
What are the key properties of N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine?
N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-[2-(2,3,4-trimethylphenyl)ethyl]ethane-1,2-diamine is sourced from PubChem (CID 115195540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).