N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine

C13H26N2O — CID 107094173

IUPACN-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
SMILESCN(C)CCOCCNC(C1CC1)C1CC1
InChIInChI=1S/C13H26N2O/c1-15(2)8-10-16-9-7-14-13(11-3-4-11)12-5-6-12/h11-14H,3-10H2,1-2H3
InChIKeyDGTSHRXAEJVVQI-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.34
Rot. Bonds9

About N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine

N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine (PubChem CID 107094173) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
PubChem CID107094173
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
SMILESCN(C)CCOCCNC(C1CC1)C1CC1
InChIInChI=1S/C13H26N2O/c1-15(2)8-10-16-9-7-14-13(11-3-4-11)12-5-6-12/h11-14H,3-10H2,1-2H3
InChIKeyDGTSHRXAEJVVQI-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.34
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-[2-[2-(dimethylamino)ethoxy]ethyl]propan-2-amine
CID 62341832
N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine
CID 81067870
N-(dicyclopropylmethyl)-N'-[2-(dimethylamino)ethyl]-N'-methylethane-1,2-diamine
CID 63725313
N-[2-[2-(dimethylamino)ethoxy]ethyl]-1-(1-methylpiperidin-3-yl)ethanamine
CID 107094221
N-(dicyclopropylmethyl)-N'-methyl-N'-(2-propan-2-yloxyethyl)ethane-1,2-diamine
CID 81067423
N-(cyclopentylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
CID 103952800
N-(dicyclopropylmethyl)-N',N'-bis(2-methylpropyl)ethane-1,2-diamine
CID 55090020
N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]cyclopropanamine
CID 102740741
N-[2-[2-(dimethylamino)ethoxy]ethyl]-4-methoxycyclohexan-1-amine
CID 107094281
N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
CID 103490801
N-(dicyclopropylmethyl)-2-(4-methylpentan-2-yloxy)ethanamine
CID 55088152
N-[2-[2-(dimethylamino)ethoxy]ethyl]-1-(4-propan-2-yloxyphenyl)ethanamine
CID 107094233

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine?
The IUPAC name of N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine (CID 107094173) is N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine.
What is the SMILES notation for N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine?
The canonical SMILES for N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine is CN(C)CCOCCNC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine?
The InChIKey is DGTSHRXAEJVVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-15(2)8-10-16-9-7-14-13(11-3-4-11)12-5-6-12/h11-14H,3-10H2,1-2H3.
What are the key properties of N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine?
N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine has a molecular weight of 226.36 g/mol, XLogP of 1.34, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine is sourced from PubChem (CID 107094173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).