N-(3-ethoxypropyl)-2-methoxypropanamide

C9H19NO3 — CID 115588519

IUPACN-(3-ethoxypropyl)-2-methoxypropanamide
SMILESCCOCCCNC(=O)C(C)OC
InChIInChI=1S/C9H19NO3/c1-4-13-7-5-6-10-9(11)8(2)12-3/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyAGRJFFDQCPENPK-UHFFFAOYSA-N
MW189.25 g/mol
LogP0.56
Rot. Bonds7

About N-(3-ethoxypropyl)-2-methoxypropanamide

N-(3-ethoxypropyl)-2-methoxypropanamide (PubChem CID 115588519) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-2-methoxypropanamide.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-2-methoxypropanamide
PubChem CID115588519
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC NameN-(3-ethoxypropyl)-2-methoxypropanamide
SMILESCCOCCCNC(=O)C(C)OC
InChIInChI=1S/C9H19NO3/c1-4-13-7-5-6-10-9(11)8(2)12-3/h8H,4-7H2,1-3H3,(H,10,11)
InChIKeyAGRJFFDQCPENPK-UHFFFAOYSA-N
XLogP0.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 50.56
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

N-(3-ethoxypropyl)-2-methylbutanamide
CID 88934597
N-[3-(cyclopropylmethoxy)propyl]-2-methoxypropanamide
CID 115588529
N-[3-(2-ethoxyethoxy)propyl]acetamide
CID 129212456
propan-2-yl N-(3-ethoxypropyl)carbamate
CID 116653800
N-(4-aminopentyl)-2-methoxypropanamide
CID 106122458
N-(3-aminopropyl)-2-(2-ethoxyethoxy)propanamide
CID 119407373
N'-(2-acetamidoethyl)-N-(3-ethoxypropyl)oxamide
CID 108505337
1-(3-ethoxypropyl)-3-ethylurea
CID 108890430
N-[2-[[N-(3-ethoxypropyl)-N'-methylcarbamimidoyl]amino]ethyl]-2-methylpropanamide;hydroiodide
CID 111223084
(2S)-2-amino-N-(3-ethoxypropyl)-3,3-dimethylbutanamide;hydrochloride
CID 119675575
4-amino-N-(3-ethoxypropyl)pentanamide;hydrochloride
CID 120558779
2-(3-chlorophenoxy)-N-(3-ethoxypropyl)propanamide
CID 46770327

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-2-methoxypropanamide?
The IUPAC name of N-(3-ethoxypropyl)-2-methoxypropanamide (CID 115588519) is N-(3-ethoxypropyl)-2-methoxypropanamide.
What is the SMILES notation for N-(3-ethoxypropyl)-2-methoxypropanamide?
The canonical SMILES for N-(3-ethoxypropyl)-2-methoxypropanamide is CCOCCCNC(=O)C(C)OC.
What is the InChIKey of N-(3-ethoxypropyl)-2-methoxypropanamide?
The InChIKey is AGRJFFDQCPENPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3/c1-4-13-7-5-6-10-9(11)8(2)12-3/h8H,4-7H2,1-3H3,(H,10,11).
What are the key properties of N-(3-ethoxypropyl)-2-methoxypropanamide?
N-(3-ethoxypropyl)-2-methoxypropanamide has a molecular weight of 189.25 g/mol, XLogP of 0.56, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-2-methoxypropanamide is sourced from PubChem (CID 115588519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).