N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine

C11H25NO3 — CID 103490751

IUPACN-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine
SMILESCCOCC(C)OCCNCCCOC
InChIInChI=1S/C11H25NO3/c1-4-14-10-11(2)15-9-7-12-6-5-8-13-3/h11-12H,4-10H2,1-3H3
InChIKeyRHBBOKQEXGQDIP-UHFFFAOYSA-N
MW219.32 g/mol
LogP1.05
Rot. Bonds11

About N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine

N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine (PubChem CID 103490751) has the molecular formula C11H25NO3 and a molecular weight of 219.32 g/mol. Its IUPAC name is N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine.

Molecular Properties

Compound NameN-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine
PubChem CID103490751
Molecular FormulaC11H25NO3
Molecular Weight219.32 g/mol
Exact Mass219.18
IUPAC NameN-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine
SMILESCCOCC(C)OCCNCCCOC
InChIInChI=1S/C11H25NO3/c1-4-14-10-11(2)15-9-7-12-6-5-8-13-3/h11-12H,4-10H2,1-3H3
InChIKeyRHBBOKQEXGQDIP-UHFFFAOYSA-N
XLogP1.05
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.32
LogP ≤ 51.05
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

4-(1-ethoxypropan-2-yloxy)-N-(2-methoxyethyl)butan-1-amine
CID 103490793
N-(2-butan-2-yloxyethyl)-3-ethoxypropan-1-amine
CID 62583430
N-[2-(1-ethoxypropan-2-yloxy)ethyl]-N',N'-dimethylethane-1,2-diamine
CID 103490717
N-[2-(2-ethoxyethoxy)ethyl]-3-methoxypropan-1-amine
CID 62565586
N'-(1-ethoxypropan-2-yl)-N-(3-methoxypropyl)methanediamine
CID 57301622
N-(2-butan-2-yloxyethyl)-4-ethoxybutan-1-amine
CID 62583063
N-(cyclopentylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
CID 103490795
N-(2-methoxyethyl)-3-(4-methylpentan-2-yloxy)propan-1-amine
CID 62570955
4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine
CID 103490477
N-(cyclohexylmethyl)-2-(1-ethoxypropan-2-yloxy)ethanamine
CID 103490752
2-[2-(2-methoxyethoxy)ethoxy]-N-(3-methoxypropyl)propan-1-amine
CID 104567209
1-ethoxypropan-2-yl 2-(2-methoxyethylamino)acetate
CID 103488949

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine?
The IUPAC name of N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine (CID 103490751) is N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine.
What is the SMILES notation for N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine?
The canonical SMILES for N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine is CCOCC(C)OCCNCCCOC.
What is the InChIKey of N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine?
The InChIKey is RHBBOKQEXGQDIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3/c1-4-14-10-11(2)15-9-7-12-6-5-8-13-3/h11-12H,4-10H2,1-3H3.
What are the key properties of N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine?
N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine has a molecular weight of 219.32 g/mol, XLogP of 1.05, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine is sourced from PubChem (CID 103490751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).