N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine

C14H27NO2 — CID 103490801

IUPACN-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
SMILESCCOCC(C)OCCNC(C1CC1)C1CC1
InChIInChI=1S/C14H27NO2/c1-3-16-10-11(2)17-9-8-15-14(12-4-5-12)13-6-7-13/h11-15H,3-10H2,1-2H3
InChIKeyJZDUSAPKEHVPHN-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.21
Rot. Bonds10

About N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine

N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine (PubChem CID 103490801) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
PubChem CID103490801
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
SMILESCCOCC(C)OCCNC(C1CC1)C1CC1
InChIInChI=1S/C14H27NO2/c1-3-16-10-11(2)17-9-8-15-14(12-4-5-12)13-6-7-13/h11-15H,3-10H2,1-2H3
InChIKeyJZDUSAPKEHVPHN-UHFFFAOYSA-N
XLogP2.21
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.21
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-(4-methylpentan-2-yloxy)ethanamine
CID 55088152
N-(cyclopentylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
CID 103490795
N-(cyclohexylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
CID 103490752
N-[2-(1-ethoxypropan-2-yloxy)ethyl]heptan-2-amine
CID 103490806
(2R)-1,2-diethoxypropane
CID 92973991
N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine
CID 81067870
4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine
CID 103490477
N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine
CID 103490751
N-[2-(1-ethoxypropan-2-yloxy)ethyl]-N',N'-dimethylethane-1,2-diamine
CID 103490717
2-(1-ethoxypropan-2-yloxy)ethanethiol
CID 103491367
2-(2-chloroethoxy)-1-ethoxypropane
CID 103487889
N-(dicyclopropylmethyl)-2-[2-(dimethylamino)ethoxy]ethanamine
CID 107094173

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine?
The IUPAC name of N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine (CID 103490801) is N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine.
What is the SMILES notation for N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine?
The canonical SMILES for N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine is CCOCC(C)OCCNC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine?
The InChIKey is JZDUSAPKEHVPHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-3-16-10-11(2)17-9-8-15-14(12-4-5-12)13-6-7-13/h11-15H,3-10H2,1-2H3.
What are the key properties of N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine?
N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine has a molecular weight of 241.37 g/mol, XLogP of 2.21, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine is sourced from PubChem (CID 103490801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).