3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide

C9H20N2O3 — CID 106113210

IUPAC3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide
SMILESCCOCCN(C)C(=O)C(CN)OC
InChIInChI=1S/C9H20N2O3/c1-4-14-6-5-11(2)9(12)8(7-10)13-3/h8H,4-7,10H2,1-3H3
InChIKeyKAHSRBCEQDKLRF-UHFFFAOYSA-N
MW204.27 g/mol
LogP-0.55
Rot. Bonds7

About 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide

3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide (PubChem CID 106113210) has the molecular formula C9H20N2O3 and a molecular weight of 204.27 g/mol. Its IUPAC name is 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide.

Molecular Properties

Compound Name3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide
PubChem CID106113210
Molecular FormulaC9H20N2O3
Molecular Weight204.27 g/mol
Exact Mass204.15
IUPAC Name3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide
SMILESCCOCCN(C)C(=O)C(CN)OC
InChIInChI=1S/C9H20N2O3/c1-4-14-6-5-11(2)9(12)8(7-10)13-3/h8H,4-7,10H2,1-3H3
InChIKeyKAHSRBCEQDKLRF-UHFFFAOYSA-N
XLogP-0.55
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 5-0.55
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

N-(2-ethoxyethyl)-N,2-dimethylpropanamide
CID 11423854
4-[(3-amino-2-methoxypropanoyl)-methylamino]butanoic acid
CID 106112313
3-amino-2-methoxy-N-[2-(4-methoxyphenoxy)ethyl]-N-methylpropanamide
CID 106111938
2-amino-N-(2-ethoxyethyl)-N-methylpentanamide
CID 81058843
3-amino-N-(2-ethoxyethyl)-N-methylpropanamide
CID 81058300
4-amino-N-(2-ethoxyethyl)-N-methylbutanamide
CID 81058942
3-amino-2-methoxy-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide
CID 106112070
2-[2-ethoxyethyl(methyl)amino]-2-oxoacetic acid
CID 81061794
6-amino-N-(2-ethoxyethyl)-N-methylhexanamide
CID 81059139
6-amino-N-(2-ethoxyethyl)-4-ethyl-N-methylhexanamide
CID 81059329
1-(2-ethoxyethyl)-3,3-diethyl-1-methylurea
CID 115887200
3,5-dibromo-N-(2-ethoxyethyl)-N-methylbenzamide
CID 103909435

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide?
The IUPAC name of 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide (CID 106113210) is 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide.
What is the SMILES notation for 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide?
The canonical SMILES for 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide is CCOCCN(C)C(=O)C(CN)OC.
What is the InChIKey of 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide?
The InChIKey is KAHSRBCEQDKLRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3/c1-4-14-6-5-11(2)9(12)8(7-10)13-3/h8H,4-7,10H2,1-3H3.
What are the key properties of 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide?
3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide has a molecular weight of 204.27 g/mol, XLogP of -0.55, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethoxyethyl)-2-methoxy-N-methylpropanamide is sourced from PubChem (CID 106113210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).