N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine

C14H28N2O — CID 81067870

IUPACN-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine
SMILESCCOCCN(C)CCNC(C1CC1)C1CC1
InChIInChI=1S/C14H28N2O/c1-3-17-11-10-16(2)9-8-15-14(12-4-5-12)13-6-7-13/h12-15H,3-11H2,1-2H3
InChIKeyDXSIVHFASICFFF-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.73
Rot. Bonds10

About N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine

N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine (PubChem CID 81067870) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine
PubChem CID81067870
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine
SMILESCCOCCN(C)CCNC(C1CC1)C1CC1
InChIInChI=1S/C14H28N2O/c1-3-17-11-10-16(2)9-8-15-14(12-4-5-12)13-6-7-13/h12-15H,3-11H2,1-2H3
InChIKeyDXSIVHFASICFFF-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.73
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-(dicyclopropylmethyl)-2-(3-methylmorpholin-4-yl)propan-1-amine
CID 75428149
1-cyclopropyl-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62539719
2-[(2S)-2-[(2-ethoxycyclopropyl)amino]propyl]-N-(2-methylpropyl)cyclopropan-1-amine
CID 173754727
N-(dicyclopropylmethyl)-2-methoxyethanamine
CID 43093035
(Dicyclopropylmethyl)(1-methoxypropan-2-yl)amine
CID 43173314
N-(dicyclopropylmethyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 43173342
1-cyclopropyl-N-(2-morpholin-4-ylethyl)ethanamine
CID 43178915
N-(1-cyclopropylethyl)-4-methyl-2-morpholin-4-ylpentan-1-amine
CID 43205317
N-(dicyclopropylmethyl)-2-morpholin-4-ylethanamine
CID 43362793
N-(dicyclopropylmethyl)-3-ethoxypropan-1-amine
CID 43362800
N-(dicyclopropylmethyl)-3-morpholin-4-ylpropan-1-amine
CID 43362847
N-(dicyclopropylmethyl)-4-methyl-2-morpholin-4-ylpentan-1-amine
CID 43362852

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine (CID 81067870) is N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine is CCOCCN(C)CCNC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine?
The InChIKey is DXSIVHFASICFFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-17-11-10-16(2)9-8-15-14(12-4-5-12)13-6-7-13/h12-15H,3-11H2,1-2H3.
What are the key properties of N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine?
N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine has a molecular weight of 240.39 g/mol, XLogP of 1.73, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 81067870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).