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

C14H24N2 — CID 116950402

IUPACN'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine
SMILESCCNCC(NC)c1ccc(C)c(C)c1C
InChIInChI=1S/C14H24N2/c1-6-16-9-14(15-5)13-8-7-10(2)11(3)12(13)4/h7-8,14-16H,6,9H2,1-5H3
InChIKeyKBHZRJXCCCGBBL-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.48
Rot. Bonds5

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

N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine (PubChem CID 116950402) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine
PubChem CID116950402
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC NameN'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine
SMILESCCNCC(NC)c1ccc(C)c(C)c1C
InChIInChI=1S/C14H24N2/c1-6-16-9-14(15-5)13-8-7-10(2)11(3)12(13)4/h7-8,14-16H,6,9H2,1-5H3
InChIKeyKBHZRJXCCCGBBL-UHFFFAOYSA-N
XLogP2.48
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N'-cyclopropyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine
CID 116950683
N'-ethyl-N-methyl-1-(2,4,5-trimethylphenyl)ethane-1,2-diamine
CID 116950342
N,N'-dimethyl-1-(2,3,4-trimethylphenyl)butane-1,4-diamine
CID 116949515
1-(2,4-dimethoxy-3-methylphenyl)-N'-ethyl-N-methylethane-1,2-diamine
CID 116950345
2-ethyl-N,N'-dimethyl-1-(2,3,4-trimethylphenyl)propane-1,3-diamine
CID 116960845
2,2-dimethyl-4-(methylamino)-4-(2,3,4-trimethylphenyl)butanoic acid
CID 116953757
N-methyl-2-piperidin-4-yl-1-(2,3,4-trimethylphenyl)ethanamine
CID 116951835
N-methyl-2-piperazin-1-yl-1-(2,3,4-trimethylphenyl)ethanamine
CID 116954929
N'-ethyl-1-(2-methoxy-4-propan-2-ylphenyl)-N-methylethane-1,2-diamine
CID 116950339
2-(ethylamino)-1-(2-methoxy-3,4-dimethylphenyl)ethanol
CID 103434593
1-(2-methoxy-3,4-dimethylphenyl)-N-methylbutan-1-amine
CID 103433382
2-[methylamino-(2,3,4-trimethylphenyl)methyl]butanenitrile
CID 116960620

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine (CID 116950402) is N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine is CCNCC(NC)c1ccc(C)c(C)c1C.
What is the InChIKey of N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine?
The InChIKey is KBHZRJXCCCGBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-6-16-9-14(15-5)13-8-7-10(2)11(3)12(13)4/h7-8,14-16H,6,9H2,1-5H3.
What are the key properties of N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine?
N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N-methyl-1-(2,3,4-trimethylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 116950402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).