N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine

C14H24N2O2 — CID 55087335

IUPACN-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine
SMILESCOCCNCCCN(C)c1cccc(OC)c1
InChIInChI=1S/C14H24N2O2/c1-16(10-5-8-15-9-11-17-2)13-6-4-7-14(12-13)18-3/h4,6-7,12,15H,5,8-11H2,1-3H3
InChIKeyUYWBLTFULCOERZ-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.76
Rot. Bonds9

About N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine

N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine (PubChem CID 55087335) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine
PubChem CID55087335
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine
SMILESCOCCNCCCN(C)c1cccc(OC)c1
InChIInChI=1S/C14H24N2O2/c1-16(10-5-8-15-9-11-17-2)13-6-4-7-14(12-13)18-3/h4,6-7,12,15H,5,8-11H2,1-3H3
InChIKeyUYWBLTFULCOERZ-UHFFFAOYSA-N
XLogP1.76
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-N'-(4-methoxyphenyl)-N'-methylpropane-1,3-diamine
CID 62562567
N-(2-methoxyethyl)-3-(3-methoxyphenoxy)propan-1-amine
CID 62573044
N-(2-methoxyethyl)-4-(3-methoxyphenoxy)butan-1-amine
CID 62572887
N-(6-chlorohexyl)-3-methoxy-N-methylaniline
CID 62227835
N-(2-methoxyethyl)-N'-(4-methoxyphenyl)-N'-methylethane-1,2-diamine
CID 62573488
N,N-diethyl-3-[3-(2-methoxyethylamino)propoxy]aniline
CID 62582854
4-(3-methoxy-N-methylanilino)butanehydrazide
CID 63583591
N-ethyl-3-methoxy-N-methylaniline
CID 67357774
N-[2-(2-aminoethoxy)ethyl]-3-methoxy-N-methylaniline
CID 79479150
N'-(3-methoxyphenyl)-N'-methyl-N-(2-thiophen-3-ylethyl)ethane-1,2-diamine
CID 62556181
5-methoxy-1-N-(3-methoxyphenyl)-1-N-methylpentane-1,2-diamine
CID 81101880
N'-(3-methoxyphenyl)-N',2,2-trimethylhexane-1,6-diamine
CID 106708049

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine?
The IUPAC name of N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine (CID 55087335) is N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine.
What is the SMILES notation for N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine?
The canonical SMILES for N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine is COCCNCCCN(C)c1cccc(OC)c1.
What is the InChIKey of N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine?
The InChIKey is UYWBLTFULCOERZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-16(10-5-8-15-9-11-17-2)13-6-4-7-14(12-13)18-3/h4,6-7,12,15H,5,8-11H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine?
N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine has a molecular weight of 252.36 g/mol, XLogP of 1.76, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N'-(3-methoxyphenyl)-N'-methylpropane-1,3-diamine is sourced from PubChem (CID 55087335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).