4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine

C10H23NO2 — CID 103490477

IUPAC4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine
SMILESCCOCC(C)OCCCCNC
InChIInChI=1S/C10H23NO2/c1-4-12-9-10(2)13-8-6-5-7-11-3/h10-11H,4-9H2,1-3H3
InChIKeyKUAZLUAASKVJJH-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.43
Rot. Bonds9

About 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine

4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine (PubChem CID 103490477) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine.

Molecular Properties

Compound Name4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine
PubChem CID103490477
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine
SMILESCCOCC(C)OCCCCNC
InChIInChI=1S/C10H23NO2/c1-4-12-9-10(2)13-8-6-5-7-11-3/h10-11H,4-9H2,1-3H3
InChIKeyKUAZLUAASKVJJH-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.43
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

4-(1-ethoxypropan-2-yloxy)-N-(2-methoxyethyl)butan-1-amine
CID 103490793
1-[1-(1-ethoxypropan-2-yloxy)propan-2-yloxy]hexane
CID 155168253
N-[2-(1-ethoxypropan-2-yloxy)ethyl]-3-methoxypropan-1-amine
CID 103490751
(2R)-1,2-diethoxypropane
CID 92973991
2-(1-ethoxypropan-2-yloxy)ethanethiol
CID 103491367
2-(2-chloroethoxy)-1-ethoxypropane
CID 103487889
9-(1-ethoxypropan-2-yloxy)nonane-1-sulfonamide
CID 103491019
4-(1-ethoxypropan-2-yloxy)butanoic acid
CID 103486155
1-(2-hexoxypropoxy)hexane
CID 71353992
1-(1-propoxypropan-2-yloxy)pentane
CID 154093458
N-[2-(1-ethoxypropan-2-yloxy)ethyl]heptan-2-amine
CID 103490806
ethyl 6-(1-ethoxypropan-2-yloxy)-2-methyl-2-(methylamino)hexanoate
CID 103489864

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine?
The IUPAC name of 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine (CID 103490477) is 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine.
What is the SMILES notation for 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine?
The canonical SMILES for 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine is CCOCC(C)OCCCCNC.
What is the InChIKey of 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine?
The InChIKey is KUAZLUAASKVJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-4-12-9-10(2)13-8-6-5-7-11-3/h10-11H,4-9H2,1-3H3.
What are the key properties of 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine?
4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine has a molecular weight of 189.30 g/mol, XLogP of 1.43, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethoxypropan-2-yloxy)-N-methylbutan-1-amine is sourced from PubChem (CID 103490477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).