N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine

C15H26N2O — CID 65486266

IUPACN-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine
SMILESCOCCNCCCN(C)CCc1ccccc1
InChIInChI=1S/C15H26N2O/c1-17(12-6-10-16-11-14-18-2)13-9-15-7-4-3-5-8-15/h3-5,7-8,16H,6,9-14H2,1-2H3
InChIKeyNMGZPTUYTWHSBI-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.79
Rot. Bonds10

About N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine

N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine (PubChem CID 65486266) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine
PubChem CID65486266
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine
SMILESCOCCNCCCN(C)CCc1ccccc1
InChIInChI=1S/C15H26N2O/c1-17(12-6-10-16-11-14-18-2)13-9-15-7-4-3-5-8-15/h3-5,7-8,16H,6,9-14H2,1-2H3
InChIKeyNMGZPTUYTWHSBI-UHFFFAOYSA-N
XLogP1.79
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-methoxypropyl)-3-phenylpropan-1-amine
CID 28674385
N-(3-methoxypropyl)-N'-methyl-N'-(2-pyridin-4-ylethyl)ethane-1,2-diamine
CID 62560097
N-[2-(2-methoxyethoxy)ethyl]-4-phenylbutan-1-amine
CID 114333296
N'-methyl-N-(2-methylpropyl)-N'-(2-phenylethyl)pentane-1,5-diamine
CID 65486366
N'-butyl-N-(2-methoxyethyl)-N'-phenylpropane-1,3-diamine
CID 64585765
N-(2-methoxyethyl)-2-(4-phenylphenyl)ethanamine
CID 64866230
N'-methyl-N'-(2-phenylethyl)-N-propan-2-ylbutane-1,4-diamine
CID 65486365
N-(2-methoxyethyl)-N'-methyl-N'-(2-propan-2-yloxyethyl)propane-1,3-diamine
CID 81055191
N'-benzyl-N-[2-(dimethylamino)ethyl]-N'-methylpropane-1,3-diamine
CID 28577551
2-(2-methoxyethylamino)-N-phenyl-N-(2-phenylethyl)acetamide
CID 119753328
1-(2-methoxyethylamino)-3-methyl-6-phenylhexan-3-ol
CID 66002686
N,N-bis(2-methoxyethyl)-2-phenylethanamine
CID 16753331

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine?
The IUPAC name of N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine (CID 65486266) is N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine.
What is the SMILES notation for N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine?
The canonical SMILES for N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine is COCCNCCCN(C)CCc1ccccc1.
What is the InChIKey of N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine?
The InChIKey is NMGZPTUYTWHSBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-17(12-6-10-16-11-14-18-2)13-9-15-7-4-3-5-8-15/h3-5,7-8,16H,6,9-14H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine?
N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine has a molecular weight of 250.39 g/mol, XLogP of 1.79, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N'-methyl-N'-(2-phenylethyl)propane-1,3-diamine is sourced from PubChem (CID 65486266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).