4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide

C13H26N2O4 — CID 115294429

IUPAC4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide
SMILESCOCCCN(CCOC)C(=O)C1(N)CCOCC1
InChIInChI=1S/C13H26N2O4/c1-17-8-3-6-15(7-11-18-2)12(16)13(14)4-9-19-10-5-13/h3-11,14H2,1-2H3
InChIKeyPVIGTEIGHHBYBJ-UHFFFAOYSA-N
MW274.36 g/mol
LogP0.01
Rot. Bonds8

About 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide

4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide (PubChem CID 115294429) has the molecular formula C13H26N2O4 and a molecular weight of 274.36 g/mol. Its IUPAC name is 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide
PubChem CID115294429
Molecular FormulaC13H26N2O4
Molecular Weight274.36 g/mol
Exact Mass274.19
IUPAC Name4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide
SMILESCOCCCN(CCOC)C(=O)C1(N)CCOCC1
InChIInChI=1S/C13H26N2O4/c1-17-8-3-6-15(7-11-18-2)12(16)13(14)4-9-19-10-5-13/h3-11,14H2,1-2H3
InChIKeyPVIGTEIGHHBYBJ-UHFFFAOYSA-N
XLogP0.01
TPSA74.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide 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

4-amino-N-ethyl-N-(2-methoxyethyl)oxane-4-carboxamide
CID 115294699
1-amino-N,N-bis(2-methoxyethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119262683
4-amino-N-(2-methoxyethyl)-N-propan-2-yloxane-4-carboxamide
CID 82948017
3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)oxolane-3-carboxamide
CID 64891152
4-(aminomethyl)-N,N-bis(2-methoxyethyl)oxane-4-carboxamide;hydrochloride
CID 120917290
3-amino-N,N-bis(2-ethoxyethyl)oxolane-3-carboxamide
CID 82966183
4-amino-N-(2-ethoxyethyl)-N-ethyloxane-4-carboxamide
CID 113280789
4-amino-N,N-diethyloxane-4-carboxamide
CID 115293439
1-[2-methoxyethyl(3-methoxypropyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 62096795
1-amino-N-(2-cyanoethyl)-N-(2-methoxyethyl)cyclohexane-1-carboxamide
CID 63286552
4-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]oxane-4-carboxamide
CID 113280761
1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide
CID 63008768

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide?
The IUPAC name of 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide (CID 115294429) is 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide.
What is the SMILES notation for 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide?
The canonical SMILES for 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide is COCCCN(CCOC)C(=O)C1(N)CCOCC1.
What is the InChIKey of 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide?
The InChIKey is PVIGTEIGHHBYBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O4/c1-17-8-3-6-15(7-11-18-2)12(16)13(14)4-9-19-10-5-13/h3-11,14H2,1-2H3.
What are the key properties of 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide?
4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide has a molecular weight of 274.36 g/mol, XLogP of 0.01, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)oxane-4-carboxamide is sourced from PubChem (CID 115294429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).