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

C10H24N2O — CID 62570429

IUPACN-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine
SMILESCOCCNCCCNCC(C)C
InChIInChI=1S/C10H24N2O/c1-10(2)9-12-6-4-5-11-7-8-13-3/h10-12H,4-9H2,1-3H3
InChIKeyOBAKLHZYONSIBL-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.86
Rot. Bonds9

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

N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine (PubChem CID 62570429) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine
PubChem CID62570429
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC NameN-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine
SMILESCOCCNCCCNCC(C)C
InChIInChI=1S/C10H24N2O/c1-10(2)9-12-6-4-5-11-7-8-13-3/h10-12H,4-9H2,1-3H3
InChIKeyOBAKLHZYONSIBL-UHFFFAOYSA-N
XLogP0.86
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

7-methoxy-N-(2-methylpropyl)heptan-1-amine
CID 104650031
N-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-2-methylpropan-1-amine
CID 104560835
N-(2-methoxyethyl)-5-methylhexan-1-amine
CID 62603286
N,N'-bis(2-methoxyethyl)butane-1,4-diamine
CID 62568234
4-(2-methoxyethoxy)-N-(2-methylpropyl)butan-1-amine
CID 62456720
6-[2-(3-methoxypropoxy)ethoxy]-N-(2-methylpropyl)hexan-1-amine
CID 103181280
N',N'-bis(2-methoxyethyl)-N-(2-methylpropyl)butane-1,4-diamine
CID 55072636
N-ethyl-N'-[3-[3-(2-methylpropylamino)propylamino]propyl]propane-1,3-diamine
CID 58965211
N,N'-bis[2-(2-methylpropylamino)ethyl]ethane-1,2-diamine
CID 54452976
N-(2-methoxyethyl)-3-(4-methylpentan-2-yloxy)propan-1-amine
CID 62570955
N-(2-methoxyethyl)-4-(4-methylpentoxy)butan-1-amine
CID 62597263
N-ethyl-N'-(2-methylpropyl)propane-1,3-diamine
CID 55209612

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine?
The IUPAC name of N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine (CID 62570429) is N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine.
What is the SMILES notation for N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine?
The canonical SMILES for N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine is COCCNCCCNCC(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine?
The InChIKey is OBAKLHZYONSIBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-10(2)9-12-6-4-5-11-7-8-13-3/h10-12H,4-9H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine?
N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine has a molecular weight of 188.31 g/mol, XLogP of 0.86, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N'-(2-methylpropyl)propane-1,3-diamine is sourced from PubChem (CID 62570429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).