4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine

C10H23NO2 — CID 62724351

IUPAC4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine
SMILESCOCCNCC(C)(C)CCOC
InChIInChI=1S/C10H23NO2/c1-10(2,5-7-12-3)9-11-6-8-13-4/h11H,5-9H2,1-4H3
InChIKeyCZEFAKXDTOFOTM-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.29
Rot. Bonds8

About 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine

4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine (PubChem CID 62724351) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine.

Molecular Properties

Compound Name4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine
PubChem CID62724351
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine
SMILESCOCCNCC(C)(C)CCOC
InChIInChI=1S/C10H23NO2/c1-10(2,5-7-12-3)9-11-6-8-13-4/h11H,5-9H2,1-4H3
InChIKeyCZEFAKXDTOFOTM-UHFFFAOYSA-N
XLogP1.29
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.29
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-ethoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine
CID 62725159
N-(2-methoxyethyl)-2,2-dimethylhexan-1-amine
CID 62726160
3-(2-methoxyethylamino)-2,2-dimethylpropan-1-ol
CID 81413606
4-ethylsulfonyl-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine
CID 62726162
4-[2-[2-(2-methoxyethoxy)ethoxy]ethylamino]-3,3-dimethylbutan-1-ol
CID 106146692
N-(2-cyclohexylethyl)-4-methoxy-2,2-dimethylbutan-1-amine
CID 103529191
4-chloro-N-[2-(3-methoxypropoxy)ethyl]-2,2-dimethylbutan-1-amine
CID 106140042
N-(2-methoxyethyl)-2,2,4-trimethylhexan-1-amine
CID 62725752
N-[2-(3-methoxypropoxy)ethyl]-2,2-dimethylheptan-1-amine
CID 103179208
5-(4-methoxybutylamino)-4,4-dimethylpentan-1-ol
CID 106147134
N-(2-methoxyethyl)-N'-(2-methoxy-2-methylpropyl)ethane-1,2-diamine
CID 103019907
N-(2-methoxyethyl)-2,2-dimethyl-4-naphthalen-1-ylbutan-1-amine
CID 65306366

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine?
The IUPAC name of 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine (CID 62724351) is 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine.
What is the SMILES notation for 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine?
The canonical SMILES for 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine is COCCNCC(C)(C)CCOC.
What is the InChIKey of 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine?
The InChIKey is CZEFAKXDTOFOTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-10(2,5-7-12-3)9-11-6-8-13-4/h11H,5-9H2,1-4H3.
What are the key properties of 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine?
4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine has a molecular weight of 189.30 g/mol, XLogP of 1.29, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-methoxyethyl)-2,2-dimethylbutan-1-amine is sourced from PubChem (CID 62724351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).