N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide

C9H20N2O2 — CID 81058236

IUPACN-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide
SMILESCCOCCN(C)C(=O)CCNC
InChIInChI=1S/C9H20N2O2/c1-4-13-8-7-11(3)9(12)5-6-10-2/h10H,4-8H2,1-3H3
InChIKeyKHBVRMQPIHBJCZ-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.09
Rot. Bonds7

About N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide

N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide (PubChem CID 81058236) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide
PubChem CID81058236
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC NameN-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide
SMILESCCOCCN(C)C(=O)CCNC
InChIInChI=1S/C9H20N2O2/c1-4-13-8-7-11(3)9(12)5-6-10-2/h10H,4-8H2,1-3H3
InChIKeyKHBVRMQPIHBJCZ-UHFFFAOYSA-N
XLogP0.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.09
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

3-amino-N-(2-ethoxyethyl)-N-methylpropanamide
CID 81058300
4-chloro-N-(2-ethoxyethyl)-N-methylbutanamide
CID 81059200
4-amino-N-(2-ethoxyethyl)-N-methylbutanamide
CID 81058942
6-amino-N-(2-ethoxyethyl)-N-methylhexanamide
CID 81059139
methyl 3-[3-ethoxypropanoyl(methyl)amino]propanoate
CID 62590846
methyl (2S)-2-amino-5-[2-(2-ethoxyethoxy)ethyl-methylamino]-5-oxopentanoate
CID 156858129
ethane;2-[3-ethoxypropanoyl(methyl)amino]ethyl acetate
CID 142463772
3-[2-ethoxyethyl(methyl)amino]propanoic acid
CID 60988072
2-[2-ethoxyethyl(methyl)amino]-2-oxoacetic acid
CID 81061794
methyl 4-[3-ethoxypropanoyl(methyl)amino]butanoate
CID 55210221
N,N'-dimethyl-N'-[2-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]ethyl]-N-(3,7,11,15-tetramethylhexadecyl)butanediamide
CID 59900032
2-hydroxy-N-methyl-N-[2-(methylamino)ethyl]acetamide
CID 87509746

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide?
The IUPAC name of N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide (CID 81058236) is N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide is CCOCCN(C)C(=O)CCNC.
What is the InChIKey of N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide?
The InChIKey is KHBVRMQPIHBJCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-4-13-8-7-11(3)9(12)5-6-10-2/h10H,4-8H2,1-3H3.
What are the key properties of N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide?
N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide has a molecular weight of 188.27 g/mol, XLogP of 0.09, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 81058236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).