2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine

C14H24N2 — CID 65233412

IUPAC2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
SMILESCCC(CN)CN(C)Cc1ccccc1C
InChIInChI=1S/C14H24N2/c1-4-13(9-15)10-16(3)11-14-8-6-5-7-12(14)2/h5-8,13H,4,9-11,15H2,1-3H3
InChIKeyGBCNWJZPBSVZEV-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.41
Rot. Bonds6

About 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine

2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine (PubChem CID 65233412) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine.

Molecular Properties

Compound Name2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
PubChem CID65233412
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
SMILESCCC(CN)CN(C)Cc1ccccc1C
InChIInChI=1S/C14H24N2/c1-4-13(9-15)10-16(3)11-14-8-6-5-7-12(14)2/h5-8,13H,4,9-11,15H2,1-3H3
InChIKeyGBCNWJZPBSVZEV-UHFFFAOYSA-N
XLogP2.41
TPSA29.26 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 ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-[(2,5-dimethylphenyl)methyl]-2-ethyl-N'-methylpropane-1,3-diamine
CID 115251540
2-ethyl-N'-[(2-fluorophenyl)methyl]-N'-methylpropane-1,3-diamine
CID 65233471
2-ethoxy-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine
CID 63070049
2-ethyl-N'-methyl-N'-[(2-methyl-5-propan-2-ylphenyl)methyl]propane-1,3-diamine
CID 115251583
1-N,3,3-trimethyl-1-N-[(2-methylphenyl)methyl]butane-1,2-diamine
CID 61412120
2-amino-3-[methyl-[(2-methylphenyl)methyl]amino]propan-1-ol
CID 115120751
1-N-methyl-1-N-[(2-methylphenyl)methyl]-2-N-propylbutane-1,2-diamine
CID 62039915
2-methyl-3-[methyl-[(2-methylphenyl)methyl]amino]propan-1-ol
CID 115665625
2-[[methyl-[2-(2-methylphenyl)ethyl]amino]methyl]butan-1-ol
CID 115251113
2-ethyl-N'-[(4-methoxy-2,3-dimethylphenyl)methyl]-N'-methylpropane-1,3-diamine
CID 115251582
2-ethyl-N'-methyl-N'-(thiophen-2-ylmethyl)propane-1,3-diamine
CID 65228216
N'-[(2-bromophenyl)methyl]-2-ethyl-N'-methylbutane-1,4-diamine
CID 81080827

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine?
The IUPAC name of 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine (CID 65233412) is 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine.
What is the SMILES notation for 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine?
The canonical SMILES for 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine is CCC(CN)CN(C)Cc1ccccc1C.
What is the InChIKey of 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine?
The InChIKey is GBCNWJZPBSVZEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-4-13(9-15)10-16(3)11-14-8-6-5-7-12(14)2/h5-8,13H,4,9-11,15H2,1-3H3.
What are the key properties of 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine?
2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N'-methyl-N'-[(2-methylphenyl)methyl]propane-1,3-diamine is sourced from PubChem (CID 65233412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).