4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine

C13H28N2O2 — CID 62562752

IUPAC4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine
SMILESCOCCNCCCCN1CCOCC1(C)C
InChIInChI=1S/C13H28N2O2/c1-13(2)12-17-11-9-15(13)8-5-4-6-14-7-10-16-3/h14H,4-12H2,1-3H3
InChIKeySVZBDNLXPHRYAM-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.11
Rot. Bonds8

About 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine

4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine (PubChem CID 62562752) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine.

Molecular Properties

Compound Name4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine
PubChem CID62562752
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine
SMILESCOCCNCCCCN1CCOCC1(C)C
InChIInChI=1S/C13H28N2O2/c1-13(2)12-17-11-9-15(13)8-5-4-6-14-7-10-16-3/h14H,4-12H2,1-3H3
InChIKeySVZBDNLXPHRYAM-UHFFFAOYSA-N
XLogP1.11
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-4-ethoxybutan-1-amine
CID 55089270
2-(3,3-dimethylmorpholin-4-yl)-N-(2-ethoxyethyl)ethanamine
CID 62558951
5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
CID 62461860
4-(4-bromobutyl)-3,3-dimethylmorpholine
CID 61430684
3-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpropan-1-amine
CID 61430784
methyl 3-(3,3-dimethylmorpholin-4-yl)propanoate
CID 61433080
3-(3,3-dimethylmorpholin-4-yl)propan-1-ol
CID 54352391
3-(4,4-dimethylpiperidin-1-yl)-N-(2-methoxyethyl)propan-1-amine
CID 62932034
2-(2,2-dimethylpyrrolidin-1-yl)-N-(2-methoxyethyl)ethanamine
CID 63218107
N,N'-bis(2-methoxyethyl)butane-1,4-diamine
CID 62568234
4-(azepan-1-yl)-N-(2-methoxyethyl)butan-1-amine
CID 62568410
6-(3,3-dimethylmorpholin-4-yl)-3,3-dimethylhexan-1-amine
CID 65296338

Frequently Asked Questions

What is the IUPAC name of 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine?
The IUPAC name of 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine (CID 62562752) is 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine.
What is the SMILES notation for 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine?
The canonical SMILES for 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine is COCCNCCCCN1CCOCC1(C)C.
What is the InChIKey of 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine?
The InChIKey is SVZBDNLXPHRYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-13(2)12-17-11-9-15(13)8-5-4-6-14-7-10-16-3/h14H,4-12H2,1-3H3.
What are the key properties of 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine?
4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine has a molecular weight of 244.38 g/mol, XLogP of 1.11, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine is sourced from PubChem (CID 62562752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).